Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Dibutyl Phthalate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.81 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.81 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.81 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.73 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.73 |
| ▸ | TP53 | P04637 | 1/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.71 |
| ▸ | LMNA | P02545 | 1/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Dibutyl Phthalate SCHEMBL5442923 | 1.00 | TSHR (0.81) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL27879861 | 0.98 | TSHR (0.78) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL14976820 | 0.97 | ALDH1A1 (0.77) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL28621680 | 0.95 | TSHR (0.83) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Dibutyl Phthalate SCHEMBL28621681 | 0.95 | TSHR (0.83) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Adipic Acid SCHEMBL9787253 | 0.94 | ALDH1A1 (0.82) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Adipic Acid SCHEMBL28088267 | 0.94 | ALDH1A1 (0.82) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Sebacic Acid SCHEMBL28015861 | 0.94 | ALDH1A1 (0.82) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Sebacic Acid SCHEMBL27848500 | 0.94 | ALDH1A1 (0.82) | TSHRTDP1L3MBTL1CYP3A4MAPK1 | |
| Palmitic Acid SCHEMBL28150013 | 0.94 | ALDH1A1 (0.82) | TSHRTDP1L3MBTL1CYP3A4MAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110178609-A | Techniques in Dry-farming Areas whole life cycle design and its preparation method and application | 兰州鑫银环橡塑制品有限公司 | 2019-08-30 | — | — | CN | claimed |
| CN-108884303-A | Thermoplastic compounds | 富科塑制品有限公司 | 2018-11-23 | — | — | CN | claimed |
| CN-109553945-A | A kind of environment protection type heat insulating plastic film and its preparation process | 金华市秸和环保技术咨询有限公司 | 2019-04-02 | — | — | CN | disclosed |
| CN-108192105-A | A kind of biology base Biodegradable multiblock polymer and its preparation method and application | 王肖桦 | 2018-06-22 | — | — | CN | disclosed |
| CN-106192985-A | A kind of environment-friendly type drainage by electroosmosis part and preparation method thereof | 江苏澳盛复合材料科技有限公司 | 2016-12-07 | — | — | CN | disclosed |