Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL4864527 | 0.82 | PTPN1 (0.60) | CYP2D6CYP2C9CYP2C19PTPN1OPRM1 | |
| SCHEMBL4865816 | 0.77 | ALDH1A1 (0.53) | CYP2D6CYP2C9CYP2C19CYP1A2ALDH1A1 | |
| SCHEMBL11628064 | 0.75 | PTPN1 (0.53) | PTPN1OPRM1OPRK1ALDH1A1ACKR3 | |
| SCHEMBL4865028 | 0.74 | PTPN1 (0.68) | CYP2D6CYP2C9CYP2C19CYP1A2PTPN1 | |
| Hydrochloric Acid SCHEMBL4862375 | 0.73 | PTPN1 (0.51) | CYP2D6CYP2C9CYP2C19CYP1A2PTPN1 | |
| SCHEMBL13623008 | 0.72 | ALDH1A1 (0.63) | CYP1A2ALDH1A1MEN1KMT2AMAPT | |
| Hydrochloric Acid SCHEMBL1025685 | 0.72 | ALDH1A1 (0.61) | CYP1A2ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL4865811 | 0.71 | NAMPT (0.65) | PTPN1OPRM1OPRK1ALDH1A1ACKR3 | |
| SCHEMBL4582840 | 0.71 | PTPN1 (0.63) | CYP2D6CYP2C9CYP2C19CYP1A2PTPN1 | |
| Hydrochloric Acid SCHEMBL4862364 | 0.71 | PTPN1 (0.60) | CYP2D6CYP2C9CYP2C19CYP1A2PTPN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7384963-B2 | 2′-Methyl-5-(1,3,4-oxadiazol-2-yl)1, 1′-biphenyl-4-carboxaide derivatives and their use as p38 kinase | GLAXO GROUP LIMITED (GB) | 2008-06-10 | — | — | US | disclosed |