Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.67 |
| ▸ | P4HB | P07237 | 1/20 | 0.53 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.51 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.51 |
| ▸ | AXL | P30530 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | ERN1 | O75460 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | AKT1 | P31749 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16111856 | 0.86 | KMO (0.69) | KMOP4HBMKNK1MKNK2MEN1 | |
| SCHEMBL27605046 | 0.82 | KMO (0.77) | KMOP4HBMKNK1MKNK2MEN1 | |
| SCHEMBL1583591 | 0.81 | ALDH1A1 (0.59) | MEN1CYP1A2CYP3A4ALDH1A1AKT1 | |
| SCHEMBL8431770 | 0.81 | AKT1 (0.57) | KMOMEN1CYP3A4ALDH1A1ERN1 | |
| SCHEMBL29569537 | 0.80 | KMO (1.00) | KMOMKNK1MKNK2MEN1PSIP1 | |
| SCHEMBL28297133 | 0.80 | KMO (1.00) | KMOMKNK1MKNK2MEN1PSIP1 | |
| SCHEMBL206541 | 0.80 | KMO (1.00) | KMOMKNK1MKNK2MEN1PSIP1 | |
| SCHEMBL30114603 | 0.80 | KMO (0.65) | KMOP4HBMKNK1MKNK2MEN1 | |
| SCHEMBL205967 | 0.79 | KMO (0.73) | KMOP4HBMKNK1MKNK2MEN1 | |
| SCHEMBL608617 | 0.79 | KMO (0.73) | KMOMKNK1MKNK2MEN1PSIP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993019047-A1 | TETRAHIDROPYRIDINYL (3/4) SUBSTITUED OXIMES HAVING SIGMA RECEPTOR AFFINITY AND THEIR USE IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM CONDITIONS | WARNER-LAMBERT COMPANY (US) | 1993-09-30 | — | — | WO | disclosed |
| US-3991197-A | ANALGESICS | HOFFMANN-LA ROCHE INC. (US) | 1976-11-09 | — | — | US | disclosed |