Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 10/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | BCKDK | O14874 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | TBXAS1 | P24557 | 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 | |
|---|---|---|---|---|
| SCHEMBL31126960 | 0.80 | ALDH1A1 (0.45) | NPSR1TRPM8KDM4E | |
| SCHEMBL2889379 | 0.77 | GPR35 (0.44) | GPR35PKMNPSR1RXFP1MCL1 | |
| SCHEMBL2893771 | 0.73 | GPR35 (0.58) | GPR35PKMNPSR1RXFP1BCKDK | |
| SCHEMBL31126901 | 0.71 | ERN1 (0.34) | — | |
| SCHEMBL31126894 | 0.71 | DHODH (0.32) | AKR1B1 | |
| SCHEMBL20561760 | 0.71 | GPR35 (0.42) | GPR35PKMNPSR1RXFP1BCKDK | |
| SCHEMBL2895162 | 0.70 | BCKDK (0.67) | GPR35PKMNPSR1RXFP1BCKDK | |
| SCHEMBL3687153 | 0.68 | GPR35 (0.59) | GPR35PKMNPSR1RXFP1BCKDK | |
| SCHEMBL31207537 | 0.67 | GPR35 (0.48) | GPR35PKMNPSR1RXFP1MKNK2 | |
| SCHEMBL2610279 | 0.67 | GPR35 (0.51) | GPR35PKMNPSR1RXFP1BCKDK |
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-7732477-B2 | N-(1-azabicyclo[2.2.2]oct-3-yl)-heteroaryl carboxamides; alpha 7-nicotinic acetylcholine receptors (nAChR) agonists; improving perception, concentration, learning and memory; neuropathic pain; acute and chronic pain | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-08 | — | — | US | disclosed |