Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | QPCT | Q16769 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9849439 | 0.77 | CYP19A1 (0.48) | CYP19A1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL5655099 | 0.73 | CYP19A1 (0.84) | CYP19A1KMT2AMAOAMAOBQPCT | |
| SCHEMBL5105572 | 0.72 | POLB (0.50) | CYP19A1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL7117493 | 0.72 | CYP19A1 (0.53) | CYP19A1KMT2AALDH1A1KDM4ELMNA | |
| SCHEMBL9849448 | 0.71 | CYP19A1 (0.55) | CYP19A1KMT2AMEN1 | |
| SCHEMBL1817755 | 0.70 | POLB (0.59) | KMT2APOLBALDH1A1LMNAMAPT | |
| SCHEMBL9849431 | 0.69 | MAOA (0.56) | CYP19A1KMT2APOLBALDH1A1KDM4E | |
| SCHEMBL18940340 | 0.69 | CYP19A1 (0.49) | CYP19A1 | |
| SCHEMBL28046347 | 0.69 | HTT (0.42) | KMT2APOLBALDH1A1LMNAMAPT | |
| Hydrochloric Acid SCHEMBL9663692 | 0.69 | CYP19A1 (0.80) | CYP19A1KMT2AMAOAMAOBQPCT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0446604-A2 | Pyridine and related aza heterocycle derivatives as cardiovascular agents | AMERICAN CYANAMID COMPANY (US) | 1991-09-18 | — | — | EP | disclosed |