Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CNR1 | P21554 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | FPR2 | P25090 | 4/20 | 0.41 |
| ▸ | FPR1 | P21462 | 3/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL8904998 | 1.00 | CCKBR (0.49) | CCKBRLMNACNR1CYP2C19NPC1 | |
| SCHEMBL8904475 | 0.88 | MEN1 (0.47) | LMNANPC1ALDH1A1EPHX1RAB9A | |
| SCHEMBL8904470 | 0.88 | MEN1 (0.47) | LMNANPC1ALDH1A1EPHX1RAB9A | |
| SCHEMBL8903006 | 0.81 | CCKBR (0.52) | CCKBRLMNACYP2C19NPC1ALDH1A1 | |
| SCHEMBL8903170 | 0.81 | CCKBR (0.52) | CCKBRLMNACYP2C19NPC1ALDH1A1 | |
| SCHEMBL8905552 | 0.81 | CCKBR (0.52) | CCKBRLMNACYP2C19NPC1ALDH1A1 | |
| SCHEMBL8136446 | 0.79 | HSD17B10 (0.46) | NPC1ALDH1A1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL8166405 | 0.79 | HSD17B10 (0.46) | NPC1ALDH1A1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL7485886 | 0.79 | HSD17B10 (0.46) | NPC1ALDH1A1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL8904435 | 0.79 | MAPT (0.53) | CCKBRNPC1ALDH1A1RAB9ASMN1; SMN2 |
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-5618808-A | Benzothiazepine and benzoxazepine derivatives as cholecystokinin receptor antagonists | PFIZER, INC. (US) | 1997-04-08 | — | — | US | disclosed |
| WO-1994001421-A1 | BENZOTHIAZEPINE AND BENZOXAZEPINE DERIVATIVES AS CHOLECYSTOKININ RECEPTOR ANTAGONISTS | PFIZER INC. (US) | 1994-01-20 | — | — | WO | disclosed |