Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.39 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.39 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.39 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.39 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.39 |
| ▸ | PSMA3 | P25788 | 1/20 | 0.39 |
| ▸ | PSMA4 | P25789 | 1/20 | 0.39 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.39 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.39 |
| ▸ | PSMA5 | P28066 | 1/20 | 0.39 |
| ▸ | PSMB4 | P28070 | 1/20 | 0.39 |
| ▸ | PSMB6 | P28072 | 1/20 | 0.39 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.39 |
| ▸ | PSMB10 | P40306 | 1/20 | 0.39 |
| ▸ | PSMB3 | P49720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9474666 | 0.85 | CNR1 (0.60) | CNR1CNR2CYP3A4ALDH1A1PSMB11 | |
| SCHEMBL9475226 | 0.85 | CNR1 (0.60) | CNR1CNR2CYP3A4ALDH1A1PSMB11 | |
| SCHEMBL11489249 | 0.84 | LMNA (0.52) | CNR1CNR2ALDH1A1PSMB11PSMA7 | |
| SCHEMBL9508860 | 0.84 | P2RY12 (0.44) | P2RY12HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL9474478 | 0.84 | CNR1 (0.64) | CNR1CNR2CYP3A4ALDH1A1PSMB11 | |
| SCHEMBL9474467 | 0.84 | CNR1 (0.64) | CNR1CNR2CYP3A4ALDH1A1PSMB11 | |
| SCHEMBL11067406 | 0.83 | SMN1; SMN2 (0.53) | CNR1CNR2ALDH1A1 | |
| SCHEMBL9506549 | 0.81 | HDAC3 (0.40) | P2RY12ALDH1A1HDAC1HDAC2HDAC3 | |
| SCHEMBL9510451 | 0.79 | HDAC1 (0.41) | P2RY12HDAC1HDAC2HDAC3HDAC4 | |
| SCHEMBL10109310 | 0.79 | TERT (0.50) | P2RY12 |
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-0331279-A2 | Compound and use | ZENECA LIMITED (GB) | 1989-09-06 | — | — | EP | claimed |
| US-5243047-A | Triazole/thiazole amino-s-triazine bonding agents | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-09-07 | — | — | US | disclosed |
| US-4978756-A | A 2-MERCAPTO, ALKYLANOYL, ALKENOYL OR ALKDIENOYL AMINO BENZOTHIOZOLE; METALS PROTECTIVE COATING; IMPROVED BONDING OF METALS AND RUBBER; TIRE CORDS | ICI AMERICAS INC. (US) | 1990-12-18 | — | — | US | disclosed |
| EP-0331279-A2 | Compound and use | ZENECA LIMITED (GB) | 1989-09-06 | — | — | EP | disclosed |