Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dinitrophenylene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | CA12 | O43570 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.60 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.60 |
| ▸ | HPGD | P15428 | 1/20 | 0.60 |
| ▸ | CA4 | P22748 | 1/20 | 0.60 |
| ▸ | CA6 | P23280 | 1/20 | 0.60 |
| ▸ | CA7 | P43166 | 1/20 | 0.60 |
| ▸ | CA9 | Q16790 | 1/20 | 0.60 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.60 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | KCNMA1 | Q12791 | 3/20 | 0.55 |
| ▸ | CES2 | O00748 | 1/20 | 0.54 |
| ▸ | CES1 | P23141 | 1/20 | 0.54 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Salicylic Acid SCHEMBL27624714 | 0.88 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| Dinitrophenylene SCHEMBL27684693 | 0.88 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| Salicylic Acid SCHEMBL11842213 | 0.87 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| Dinitrophenylene SCHEMBL27691692 | 0.84 | TSHR (0.74) | ALDH1A1SMN1; SMN2HPGDTP53TSHR | |
| Salicylic Acid SCHEMBL28475198 | 0.82 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| Salicylic Acid SCHEMBL8157144 | 0.82 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| Salicylic Acid SCHEMBL8157148 | 0.82 | ALDH1A1 (0.75) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| 4-Nitrobenzoic Acid SCHEMBL8742978 | 0.82 | TDP1 (0.68) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 | |
| Dinitrophenylene SCHEMBL27494788 | 0.81 | TSHR (0.65) | ALDH1A1SMN1; SMN2TP53TSHRLMNA | |
| Salicylic Acid SCHEMBL27506960 | 0.81 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2KDM4ECA12CA1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102482657-B | Enzyme complex from trichoderma reesei and p. funiculosum enzymes | DUPONT NUTRITION & HEALTH CO LTD | 2015-02-25 | — | — | CN | claimed |
| CN-102898630-A | Copolyarylate and its preparation method | SHANGHAI GENIUS ADVANCED MAT | 2013-01-30 | — | — | CN | claimed |
| CN-104557281-A | High-efficiency biological compound fertilizer | FUJIAN JSJMS ECOLOGICAL TECHNOLOGY CO LTD | 2015-04-29 | — | — | CN | disclosed |
| CN-102482657-B | Enzyme complex from trichoderma reesei and p. funiculosum enzymes | DUPONT NUTRITION & HEALTH CO LTD | 2015-02-25 | — | — | CN | disclosed |
| CN-103124783-A | Yeast expressing a carbohydrase for combined bioprocessing using starch and cellulose | MASCOMA CORP | 2013-05-29 | — | — | CN | disclosed |
| CN-102898630-A | Copolyarylate and its preparation method | SHANGHAI GENIUS ADVANCED MAT | 2013-01-30 | — | — | CN | disclosed |
| CN-102732433-A | Strain capable of producing compound enzyme and method of using same to prepare compound enzyme for weaned piglets | INST BIOLOG CO LTD HENAN ACADEMY OF SCIENCES | 2012-10-17 | — | — | CN | disclosed |
| CN-102482657-A | Enzyme complex of trichoderma reesei and penicillium funiculosum enzyme | DANISCO | 2012-05-30 | — | — | CN | disclosed |
| CN-101544511-B | Biological compound fertilizer | UNIV JILIN AGRICULTURAL | 2010-12-01 | — | — | CN | disclosed |
| CN-101050453-B | Warm start high temperature resistant DNA polymerase, and preparation method | ZHONGDE MEILIAN BIOTECH CO LTD WUXI | 2010-06-30 | — | — | CN | disclosed |
| CN-101157904-B | Producing strain for beta-dextranase | UNIV YUNNAN NORMAL | 2010-05-19 | — | — | CN | disclosed |
| CN-101544511-A | Biological compound fertilizer | UNIV JILIN AGRICULTURAL | 2009-09-30 | — | — | CN | disclosed |
| CN-100408653-C | Biological soil activating agent | UNIV JILIN AGRICULTURAL (CN) | 2008-08-06 | — | — | CN | disclosed |
| CN-101157904-A | Producing strain for beta-dextranase | UNIV YUNNAN NORMAL (CN) | 2008-04-09 | — | — | CN | disclosed |
| CN-101050453-A | Warm start high temperature resistant DNA polymerase, and preparation method | ZHONGDE MEILIAN BIOTECH CO LTD (CN) | 2007-10-10 | — | — | CN | disclosed |
| CN-1831085-A | Biological soil activating agent | UNIV JILIN AGRICULTURAL (CN) | 2006-09-13 | — | — | CN | disclosed |