Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.57 |
| ▸ | HTR2A | P28223 | 6/20 | 0.57 |
| ▸ | HTR2B | P41595 | 5/20 | 0.57 |
| ▸ | HTR1A | P08908 | 5/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.57 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.57 |
| ▸ | HTR1D | P28221 | 3/20 | 0.57 |
| ▸ | HTR1B | P28222 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | BLM | P54132 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | HTR7 | P34969 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6469548 | 0.90 | HTR2C (0.60) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL29414816 | 0.83 | HTR2C (0.55) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL6516528 | 0.83 | HTR2C (0.55) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL7159098 | 0.81 | HTR2C (0.54) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL7640404 | 0.81 | HTR2C (0.67) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL38656762 | 0.77 | HTR2C (0.50) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL6978983 | 0.77 | HTR2C (0.54) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL1667862 | 0.76 | NPSR1 (0.59) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL2494144 | 0.76 | HTR2C (0.52) | HTR2CHTR2AHTR2BHTR1ACYP2D6 | |
| SCHEMBL10821180 | 0.75 | NPSR1 (0.51) | HTR2CHTR2AHTR2BHTR1ACYP2D6 |
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-0991645-A1 | BIS-INDOLE DERIVATIVES HAVING ANTIMETASTATIC ACTIVITY, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Roche Diagnostics GmbH (DE) | 2000-04-12 | — | — | EP | claimed |
| WO-1999000381-A1 | BIS-INDOLE DERIVATIVES HAVING ANTIMETASTATIC ACTIVITY, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ROCHE DIAGNOSTICS GMBH (DE) | 1999-01-07 | — | — | WO | claimed |