Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CD44 | P16070 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28847508 | 0.79 | TSHR (0.44) | ALDH1A1CYP3A4TSHRMAPTTDP1 | |
| SCHEMBL29902909 | 0.79 | ALDH1A1 (0.44) | ALDH1A1CD44NPSR1CYP3A4TSHR | |
| SCHEMBL6509415 | 0.78 | NPSR1 (0.41) | ALDH1A1HTTICMTNPSR1CYP3A4 | |
| SCHEMBL17979828 | 0.76 | CASP1 (0.45) | ALDH1A1HTTICMTCYP3A4TSHR | |
| SCHEMBL15661539 | 0.76 | PDE10A (0.45) | ALDH1A1HTTICMTNPSR1CYP3A4 | |
| SCHEMBL5951712 | 0.75 | ALDH1A1 (0.52) | ALDH1A1HTTCD44NPSR1CYP3A4 | |
| SCHEMBL2702114 | 0.73 | ICMT (0.45) | HTTICMTTDP1CA2 | |
| SCHEMBL3278996 | 0.73 | ALDH1A1 (0.57) | ALDH1A1NPSR1CYP3A4TSHRMAPK1 | |
| SCHEMBL1478491 | 0.73 | TAAR1 (0.52) | ALDH1A1HTTICMTTDP1CA2 | |
| SCHEMBL30570712 | 0.73 | TAAR1 (0.52) | ALDH1A1HTTICMTTDP1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4077316-A1 | BENZIMIDAZOLE DERIVATIVES | Pfizer Inc. (US) | 2022-10-26 | — | — | EP | disclosed |
| CN-115087655-A | Benzimidazole derivatives | 辉瑞公司 | 2022-09-20 | — | — | CN | disclosed |