Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.54 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.47 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 3/20 | 0.46 |
| ▸ | G6PD | P11413 | 1/20 | 0.43 |
| ▸ | BCKDK | O14874 | 2/20 | 0.42 |
| ▸ | PRNP | P04156 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 2/20 | 0.39 |
| ▸ | FNTB | P49356 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 2/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.38 |
| ▸ | MIF | P14174 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9229662 | 0.88 | GPR35 (0.54) | GPR35RXFP1PKMNPSR1MCL1 | |
| SCHEMBL15619574 | 0.79 | MCL1 (0.71) | GPR35RXFP1PKMNPSR1MCL1 | |
| SCHEMBL13730381 | 0.77 | ALDH1A1 (0.39) | G6PDDYRK1AMIF | |
| SCHEMBL2895162 | 0.76 | BCKDK (0.67) | GPR35RXFP1PKMNPSR1MCL1 | |
| SCHEMBL12153769 | 0.76 | MCL1 (0.71) | GPR35RXFP1PKMNPSR1MCL1 | |
| SCHEMBL2895958 | 0.76 | GPR35 (0.58) | GPR35RXFP1PKMNPSR1MCL1 | |
| SCHEMBL2896302 | 0.75 | CES2 (0.63) | GPR35RXFP1PKMNPSR1MCL1 | |
| SCHEMBL29956540 | 0.74 | ENPP2 (0.38) | G6PDDYRK1AESR1MIF | |
| SCHEMBL4195351 | 0.74 | ENPP2 (0.38) | G6PDDYRK1AESR1MIF | |
| SCHEMBL3572338 | 0.74 | GPR35 (0.55) | GPR35RXFP1PKMNPSR1MCL1 |
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 |