Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | LTK | P29376 | 1/20 | 0.48 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11048893 | 0.88 | HTT (0.48) | CHEK1PIM1IDO1LTKLIMK1 | |
| SCHEMBL9827188 | 0.83 | CHRNB2 (0.47) | CYP3A4ALDH1A1HTR7CYP1A2TSHR | |
| SCHEMBL10799637 | 0.81 | MAPT (0.43) | CHEK1PIM1IDO1LTKLIMK1 | |
| SCHEMBL4424661 | 0.80 | ALDH1A1 (0.48) | CYP3A4ALDH1A1HTR7CYP1A2TSHR | |
| SCHEMBL10391689 | 0.80 | HTT (0.48) | CHEK1PIM1IDO1LTKLIMK1 | |
| SCHEMBL11048207 | 0.80 | LMNA (0.42) | CHEK1PIM1IDO1LTKLIMK1 | |
| SCHEMBL11508113 | 0.80 | CYP3A4 (0.56) | CYP3A4ALDH1A1HTR7CYP1A2TSHR | |
| SCHEMBL473377 | 0.78 | DRD4 (0.52) | CHEK1PIM1IDO1LTKLIMK1 | |
| SCHEMBL10891643 | 0.78 | MCHR1 (0.52) | MAPTHTTRAPGEF4MCHR1 | |
| SCHEMBL3224710 | 0.77 | F2R (0.50) | CYP3A4ALDH1A1HTR7CYP1A2TSHR |
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-4485042-A | COLORFASTNESS | CASSELLA AKTIENGESELLSCHAFT (DE) | 1984-11-27 | — | — | US | disclosed |
| EP-0073387-A1 | Water-soluble polyazo dyestuffs, their preparation and their use | CASSELLA Aktiengesellschaft (DE) | 1983-03-09 | — | — | EP | disclosed |