Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 15/20 | 0.67 |
| ▸ | HTR1A | P08908 | 14/20 | 0.67 |
| ▸ | HTR1D | P28221 | 12/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | HTR2A | P28223 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.52 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL5469807 | 0.97 | HTR1B (0.67) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL5471454 | 0.97 | HTR1B (0.71) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL5465870 | 0.94 | HTR1B (0.72) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL11536520 | 0.86 | HTR1B (0.76) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL23269931 | 0.85 | HTR1B (0.71) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL5461339 | 0.85 | CYP2D6 (0.56) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL14961026 | 0.84 | HTR1B (0.78) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL12721122 | 0.81 | KDM4E (0.71) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL15747702 | 0.81 | KDM4E (0.71) | HTR1BHTR1AHTR1DMAPTMAPK1 | |
| SCHEMBL14960974 | 0.81 | HTR1B (0.83) | HTR1BHTR1AHTR1DMAPTMAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0971890-B1 | SUBSTITUTED ANALOGS OF INDOLE-3-CARBINOL AND OF DIINDOLYMETHANE AS ANTIESTROGENS | TEXAS A & M UNIV SYS (US) | 2002-11-27 | — | — | EP | claimed |