Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 2/20 | 0.54 |
| ▸ | HTR2C | P28335 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | HTR5A | P47898 | 1/20 | 0.53 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.53 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.53 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.50 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 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 | |
|---|---|---|---|---|
| SCHEMBL18932895 | 0.85 | TAAR1 (0.49) | HTR7CYP3A4CYP2D6CYP2C19HTR2A | |
| SCHEMBL14584257 | 0.81 | BRD3 (0.57) | HTR7CYP3A4CYP2D6CYP2C19MAPKAPK2 | |
| SCHEMBL19153086 | 0.80 | RB1 (0.48) | HTR7CYP3A4CYP2D6CYP2C19HTR2A | |
| SCHEMBL8503944 | 0.80 | HTR7 (0.62) | HTR7CYP3A4CYP2D6CYP2C19HTR2A | |
| SCHEMBL10682954 | 0.79 | HTR2A (0.53) | HTR7CYP3A4CYP2D6CYP2C19HTR2A | |
| SCHEMBL6475131 | 0.79 | HTR2A (0.56) | HTR2AHTR2CKDM4EMAPKAPK2BRD3 | |
| SCHEMBL6475138 | 0.79 | HTR2A (0.56) | HTR2AHTR2CKDM4EMAPKAPK2BRD3 | |
| SCHEMBL6482928 | 0.79 | HTR2A (0.56) | HTR2AHTR2CKDM4EMAPKAPK2BRD3 | |
| Tetrahydroharman SCHEMBL7018798 | 0.79 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19KDM4E | |
| Tetrahydroharman SCHEMBL21012020 | 0.79 | HTR7 (0.65) | HTR7CYP3A4CYP2D6CYP2C19KDM4E |
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-1319005-A2 | SUBSTITUTED AZEPINO[4,5-B]INDOLINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2003-06-18 | — | — | EP | disclosed |
| WO-2002024700-A2 | SUBSTITUTED AZEPINO[4,5b]INDOLINE DERIVATIVES | PHARMACIA & UPJOHN COMPANY (US) | 2002-03-28 | — | — | WO | disclosed |