Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 8/20 | 0.34 |
| ▸ | CNR2 | P34972 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.31 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.31 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.31 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.31 |
| ▸ | GNRHR | P30968 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5663495 | 0.94 | P2RX3 (0.38) | P2RX3CNR1CNR2ALDH1A1TDP1 | |
| SCHEMBL5663451 | 0.93 | CNR1 (0.35) | CNR1CNR2ITGB3ITGAV | |
| SCHEMBL4654781 | 0.85 | P2RX3 (0.40) | P2RX3CNR1CNR2ALDH1A1ITGB3 | |
| SCHEMBL12372084 | 0.83 | P2RX3 (0.42) | P2RX3ALDH1A1TDP1MAPTTSHR | |
| SCHEMBL4654929 | 0.77 | CAMK2D (0.37) | CNR1CNR2ITGB3ITGAVCAMK2D | |
| SCHEMBL5662320 | 0.76 | KMT2A (0.41) | P2RX3CNR1CNR2ALDH1A1TDP1 | |
| SCHEMBL5665792 | 0.76 | LMNA (0.52) | P2RX3CNR1CNR2ALDH1A1TDP1 | |
| SCHEMBL5779683 | 0.76 | S1PR1 (0.36) | P2RX3CNR1ALDH1A1 | |
| SCHEMBL5663750 | 0.75 | KMT2A (0.44) | P2RX3CNR1CNR2ALDH1A1TDP1 | |
| SCHEMBL4388255 | 0.74 | S1PR1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1307226-A2 | VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS | Bristol-Myers Squibb Pharma Company (US) | 2003-05-07 | — | — | EP | disclosed |
| WO-2001097848-A2 | VITRONECTIN RECEPTOR ANTAGONIST PHARMACEUTICALS | BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) | 2001-12-27 | — | — | WO | disclosed |