Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NLRP3 | Q96P20 | 7/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA7 | P43166 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7256931 | 0.81 | NLRP3 (0.50) | POLBSMN1; SMN2MAPK1GAAHTT | |
| SCHEMBL9816008 | 0.80 | CYP1A2 (0.58) | POLBSMN1; SMN2MAPK1GAAKDM4E | |
| SCHEMBL11765835 | 0.78 | KDM4E (0.76) | POLBSMN1; SMN2MAPK1GAAKDM4E | |
| SCHEMBL9359788 | 0.78 | NLRP3 (0.78) | POLBSMN1; SMN2MAPK1KDM4EGLA | |
| SCHEMBL8009724 | 0.78 | CYP1A2 (0.75) | POLBSMN1; SMN2MAPK1GAAHTT | |
| SCHEMBL9532866 | 0.78 | NLRP3 (0.51) | POLBSMN1; SMN2MAPK1GAAHTT | |
| SCHEMBL8782314 | 0.78 | CA12 (0.53) | POLBSMN1; SMN2MAPK1GAAHTT | |
| SCHEMBL11520630 | 0.77 | KDM4E (0.55) | POLBSMN1; SMN2MAPK1GAAHTT | |
| SCHEMBL7565510 | 0.77 | RAB9A (0.71) | POLBSMN1; SMN2MAPK1HTTKDM4E | |
| SCHEMBL2090679 | 0.76 | NLRP3 (0.79) | POLBSMN1; SMN2MAPK1KDM4EGLA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0060258-A4 | METHOD FOR PRODUCING 3,6-BIS(CARBOETHOXYAMINO)-2,5-DIAZIRIDINYL-1,4-BENZOQUINONE. | AEROJET GENERAL CO (US) | 1982-12-02 | — | — | EP | claimed |
| EP-0060258-A1 | METHOD FOR PRODUCING 3,6-BIS(CARBOETHOXYAMINO)-2,5-DIAZIRIDINYL-1,4-BENZOQUINONE. | AEROJET GENERAL CO (US) | 1982-09-22 | — | — | EP | claimed |
| US-4337196-A | FROM A DIAMINOHYDROQUINONE | UNITED STATES OF AMERICA (US) | 1982-06-29 | — | — | US | claimed |
| WO-1982000823-A1 | METHOD FOR PRODUCING 3,6-BIS(CARBOETHOXYAMINO)-2,5-DIAZIRIDINYL-1,4-BENZOQUINONE | AEROJET GENERAL CO (US) | 1982-03-18 | — | — | WO | claimed |