Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 7/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 7/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ADCY5 | O95622 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8399423 | 0.92 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3ALDH1A1DRD1 | |
| SCHEMBL8399422 | 0.92 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3ALDH1A1DRD1 | |
| SCHEMBL8924522 | 0.85 | HPGD (0.38) | SLC6A2SLC6A4SLC6A3KDM4ENPC1 | |
| SCHEMBL8924511 | 0.85 | HPGD (0.38) | SLC6A2SLC6A4SLC6A3KDM4ENPC1 | |
| SCHEMBL8398460 | 0.82 | DDB1 (0.40) | NPC1RAB9ASMN1; SMN2THRBMEN1 | |
| SCHEMBL8398461 | 0.82 | DDB1 (0.40) | NPC1RAB9ASMN1; SMN2THRBMEN1 | |
| SCHEMBL8403204 | 0.80 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3KDM4EALDH1A1 | |
| SCHEMBL8403202 | 0.80 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3KDM4EALDH1A1 | |
| SCHEMBL4867739 | 0.79 | CYP3A4 (0.40) | KDM4ECYP3A4 | |
| SCHEMBL4867731 | 0.79 | CYP3A4 (0.40) | KDM4ECYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0711283-B1 | TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS | PFIZER (US) | 1999-06-16 | — | — | EP | disclosed |
| US-5618811-A | Tetrahydro-1H-benzazepinones and hexahydroazepinones as selective cholecystokinin-B receptor antagonists | PFIZER INC. (US) | 1997-04-08 | — | — | US | disclosed |