Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | F2R | P25116 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4702813 | 0.87 | ALDH1A1 (0.45) | ALDH1A1KDM4EPOLBKMT2AMEN1 | |
| SCHEMBL7900328 | 0.84 | ALDH1A1 (0.43) | ALDH1A1KDM4ETDP1POLBKMT2A | |
| SCHEMBL7900090 | 0.83 | GAA (0.41) | KMT2AITGB3ITGA2BITGAVGAA | |
| SCHEMBL4698653 | 0.82 | LMNA (0.47) | ALDH1A1POLBITGB3ITGA2BITGAV | |
| SCHEMBL7900104 | 0.81 | APOBEC3A (0.47) | ALDH1A1KDM4ETDP1KMT2AMEN1 | |
| SCHEMBL4701020 | 0.81 | P2RY12 (0.43) | ITGB3ITGA2BITGAVGAA | |
| SCHEMBL4701238 | 0.80 | PKM (0.45) | ALDH1A1POLBKMT2AMEN1ITGB3 | |
| SCHEMBL7900498 | 0.79 | CCR1 (0.46) | ITGB3ITGA2BITGAVGAAF2R | |
| SCHEMBL4698338 | 0.79 | ALDH1A1 (0.47) | ALDH1A1KDM4EKMT2AMEN1GAA | |
| SCHEMBL7892913 | 0.78 | ITGB3 (0.40) | ALDH1A1ITGB3ITGA2BITGAVGAA |
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-1071680-B1 | N,N-DISUBSTITUTED AMIDES THAT INHIBIT THE BINDING OF INTEGRINS TO THEIR RECEPTORS | ENCYSIVE PHARMACEUTICALS INC (US) | 2008-07-23 | — | — | EP | disclosed |
| US-6194448-B1 | ANTIINFLAMMATORY AGENTS; ASTHMA; RHEUMATIC DISORDERS | TEXAS BIOTECHNOLOGY CORPORATION | 2001-02-27 | — | — | US | disclosed |