Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.54 |
| ▸ | MEN1 | O00255 | 6/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.54 |
| ▸ | TP53 | P04637 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.54 |
| ▸ | ABCB1 | P08183 | 4/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.54 |
| ▸ | AR | P10275 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8875292 | 1.00 | ABCG2 (0.58) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL8875308 | 1.00 | ABCG2 (0.58) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL10801234 | 0.85 | LMNA (0.47) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL10801230 | 0.85 | LMNA (0.47) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL8876901 | 0.82 | ABCG2 (0.62) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL8876891 | 0.82 | ABCG2 (0.62) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL15676500 | 0.79 | ABCG2 (0.65) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL31290902 | 0.79 | ABCG2 (0.68) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL8875978 | 0.77 | PPARG (0.45) | ABCG2KDM4ECYP3A4MEN1KMT2A | |
| SCHEMBL8875995 | 0.77 | PPARG (0.45) | ABCG2KDM4ECYP3A4MEN1KMT2A |
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-5605896-A | Bicyclic heterocyclic derivatives having α1 adrenergic and 5HT1A activities | RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 1997-02-25 | — | — | US | disclosed |
| US-5474994-A | Treating hypertension, urethral and lower urinary tract contractions | RECORDATI S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 1995-12-12 | — | — | US | disclosed |