Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | AQP1 | P29972 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL17586756 | 0.83 | TRPA1 (0.33) | — | |
| SCHEMBL2125652 | 0.80 | ALDH1A1 (0.36) | ALDH1A1USP2GAAMAPTAQP1 | |
| SCHEMBL19386284 | 0.73 | — | — | |
| SCHEMBL19386283 | 0.73 | — | — | |
| SCHEMBL9390303 | 0.73 | ALDH1A1 (0.39) | ALDH1A1USP2GAAMAPTAQP1 | |
| SCHEMBL24517404 | 0.73 | HSD11B1 (0.35) | ALDH1A1USP2GAAMAPTTDP1 | |
| SCHEMBL26151498 | 0.73 | ALDH1A1 (0.32) | ALDH1A1USP2GAAMAPTTDP1 | |
| SCHEMBL23765253 | 0.71 | ALDH1A1 (0.33) | ALDH1A1USP2GAAMAPTTDP1 | |
| SCHEMBL23765298 | 0.71 | ALDH1A1 (0.33) | ALDH1A1USP2GAAMAPTTDP1 | |
| SCHEMBL25474620 | 0.71 | EPHX1 (0.31) | ALDH1A1USP2GAAMAPT |
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-9771370-B2 | Compounds for the inhibition of indoleamine-2,3-dioxygenase | MERCK PATENT GMBH (DE) | 2017-09-26 | — | — | US | disclosed |