Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.48 |
| ▸ | DRD4 | P21917 | 5/20 | 0.48 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | LTA4H | P09960 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11677009 | 0.91 | LTA4H (0.39) | DRD2DRD4CRHBPCRHR2LTA4H | |
| SCHEMBL11680703 | 0.84 | DRD2 (0.45) | DRD2DRD4LTA4H | |
| SCHEMBL11786097 | 0.83 | DRD2 (0.58) | DRD2DRD4CRHBPCRHR2AMPD2 | |
| SCHEMBL11676504 | 0.80 | CRHBP (0.38) | DRD2DRD4CRHBPCRHR2AMPD2 | |
| SCHEMBL10884742 | 0.80 | CRHBP (0.40) | DRD2DRD4CRHBPCRHR2PKM | |
| SCHEMBL11426966 | 0.80 | CRHBP (0.42) | DRD2DRD4CRHBPCRHR2 | |
| SCHEMBL11431614 | 0.79 | CRHBP (0.43) | DRD2DRD4CRHBPCRHR2 | |
| SCHEMBL11839554 | 0.79 | CRHBP (0.39) | DRD2DRD4CRHBPCRHR2 | |
| SCHEMBL9155272 | 0.78 | CRHBP (0.48) | DRD2DRD4CRHBPCRHR2 | |
| SCHEMBL11679808 | 0.78 | HRH3 (0.45) | DRD2CRHBPCRHR2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4051117-A | Triazole-azo-phenyl cationic dyestuffs | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-27 | — | — | US | disclosed |
| US-4000141-A | SUBSTITUTED TETRAHYDRO QUINOLINE CATIONIC DYESTUFFS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-12-28 | — | — | US | disclosed |
| US-3991042-A | Basic azo dyestuffs containing a benzthiazole and a tetrahydroquinoline nucleus | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-09 | — | — | US | disclosed |