Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PHGDH | O43175 | 4/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PLG | P00747 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9259804 | 0.87 | MMP2 (0.44) | NQO2MMP2MMP7MMP14 | |
| SCHEMBL9568559 | 0.81 | F2 (0.41) | ITGB3ITGA2BCHEK2 | |
| SCHEMBL9257084 | 0.81 | F2 (0.41) | ITGB3ITGA2BCHEK2 | |
| SCHEMBL9253478 | 0.81 | KLK1 (0.38) | ITGB3ITGA2BNQO2CA12CA1 | |
| SCHEMBL9256770 | 0.80 | ITGB3 (0.35) | ITGB3ITGA2BNQO2ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL9254356 | 0.80 | F2 (0.40) | ITGB3ITGA2BCHEK2 | |
| SCHEMBL9259308 | 0.80 | L3MBTL1 (0.36) | ITGB3ITGA2BNQO2ALDH1A1KDM4E | |
| SCHEMBL9250717 | 0.79 | NQO2 (0.39) | NQO2PLGPLAU | |
| SCHEMBL9254303 | 0.79 | TMPRSS15 (0.43) | ITGB3ITGA2B | |
| SCHEMBL9568477 | 0.79 | TMPRSS15 (0.38) | ITGB3ITGA2BNQO2PLGPLAU |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0525629-A2 | 5-membered heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-02-03 | — | — | EP | disclosed |