Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9544511 | 0.87 | MAPT (0.42) | CYP11B1CYP11B2HTR2BKDM4EMEN1 | |
| SCHEMBL7378778 | 0.80 | KDM1A (0.41) | HTR2BMEN1TP53CYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL9372300 | 0.79 | KDM1A (0.41) | HTR2BMEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL7403640 | 0.78 | HTR2B (0.44) | HTR2BKDM4EMEN1TP53CYP1A2 | |
| SCHEMBL9545377 | 0.78 | MEN1 (0.41) | HTR2BKDM4EMEN1TP53CYP1A2 | |
| Hydrochloric Acid SCHEMBL9544563 | 0.78 | HTR2C (0.41) | HTR2BKDM4EMEN1TP53CYP1A2 | |
| SCHEMBL9542983 | 0.77 | MAPT (0.44) | HTR2BKDM4EMEN1TP53CYP1A2 | |
| SCHEMBL18962969 | 0.77 | MAPT (0.52) | CYP11B1CYP11B2HTR2BKDM4EMEN1 | |
| SCHEMBL9544220 | 0.77 | HTR2B (0.47) | HTR2BKDM4EMEN1TP53CYP1A2 | |
| Hydrochloric Acid SCHEMBL27386294 | 0.76 | HTR2C (0.53) | CYP11B1CYP11B2HTR2BKDM4EMEN1 |
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-0630373-A1 | INDOLE DERIVATIVES AS 5HT1C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1994-12-28 | — | — | EP | claimed |
| WO-1993018028-A1 | INDOLE DERIVATIVES AS 5HT1C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-09-16 | — | — | WO | claimed |
| WO-1993018028-A1 | INDOLE DERIVATIVES AS 5HT1C ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1993-09-16 | — | — | WO | disclosed |