Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 7/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.39 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.39 |
| ▸ | GRM6 | O15303 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL9799360 | 0.86 | HCAR3 (0.43) | RAB9AALDH1A1TDP1VCAM1MAPT | |
| SCHEMBL9798733 | 0.83 | MAPT (0.49) | ALDH1A1TDP1VCAM1MAPTGLA | |
| SCHEMBL5278995 | 0.83 | SMN1; SMN2 (0.48) | RAB9AALDH1A1VCAM1MAPTGLA | |
| SCHEMBL9586447 | 0.82 | MAPT (0.50) | RAB9AALDH1A1TDP1VCAM1MAPT | |
| SCHEMBL9798797 | 0.82 | HCAR3 (0.46) | RAB9AALDH1A1TDP1VCAM1MAPT | |
| SCHEMBL8436247 | 0.81 | GLA (0.54) | RAB9ATDP1VCAM1MAPTGLA | |
| SCHEMBL9798855 | 0.81 | HCAR3 (0.45) | ALDH1A1TDP1VCAM1MAPTGLA | |
| SCHEMBL9798791 | 0.81 | HCAR3 (0.45) | ALDH1A1TDP1VCAM1MAPTGLA | |
| SCHEMBL9798470 | 0.81 | HCAR3 (0.45) | ALDH1A1TDP1VCAM1MAPTGLA | |
| SCHEMBL9798673 | 0.81 | HCAR3 (0.45) | ALDH1A1TDP1VCAM1MAPTGLA |
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 |
|---|---|---|---|---|---|---|---|
| US-5865856-A | MIXTURE CONTAINING COUPLER AND DEVELOPER | WELLA AKTIENGESELLSCHAFT (DE) | 1999-02-02 | — | — | US | disclosed |
| EP-0797980-A1 | Oxidation hair dye composition comprising a 2,5-diaminobenzonitrile as well as 2,5-diaminobenzonitrile compounds | Wella Aktiengesellschaft (DE) | 1997-10-01 | — | — | EP | disclosed |