Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 4/20 | 0.45 |
| ▸ | HTR1B | P28222 | 4/20 | 0.45 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | FFAR2 | O15552 | 6/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1495876 | 0.86 | ALDH1A1 (0.49) | PDCD1CD274RAB9ASMN1; SMN2TP53 | |
| SCHEMBL6987369 | 0.81 | AVPR2 (0.47) | HTR1DHTR1BROCK2FFAR2PDCD1 | |
| Hydrochloric Acid SCHEMBL6990553 | 0.80 | AVPR2 (0.47) | HTR1DHTR1BROCK2FFAR2PDCD1 | |
| SCHEMBL6993535 | 0.79 | AVPR2 (0.59) | — | |
| SCHEMBL6619403 | 0.79 | AVPR2 (0.65) | — | |
| SCHEMBL2703870 | 0.78 | PDCD1 (0.42) | PDCD1CD274RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2616280 | 0.77 | PDCD1 (0.49) | PDCD1CD274RAB9AMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL2129494 | 0.76 | PDCD1 (0.48) | PDCD1CD274RAB9AMEN1KMT2A | |
| SCHEMBL6988182 | 0.76 | ALDH1A1 (0.54) | HTR1DHTR1BFFAR2RAB9ASMN1; SMN2 | |
| SCHEMBL27789716 | 0.75 | PDCD1 (0.44) | PDCD1CD274 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0709386-B1 | FUSED BENZAZEPINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | YAMANOUCHI PHARMA CO LTD (JP) | 2003-05-07 | — | — | EP | disclosed |
| EP-1097920-A1 | Intermediate for condensed benzazepine derivatives | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 2001-05-09 | — | — | EP | disclosed |
| EP-0709386-A1 | FUSED BENZAZEPINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-05-01 | — | — | EP | disclosed |