Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GFER | P55789 | 1/20 | 0.57 |
| ▸ | MPO | P05164 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | HTR1D | P28221 | 1/20 | 0.50 |
| ▸ | HTR1B | P28222 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 1/20 | 0.50 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.50 |
| ▸ | TUBB | P07437 | 1/20 | 0.50 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.50 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1399365 | 0.91 | HTR2A (0.61) | GFERMPOCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL737610 | 0.85 | GFER (0.64) | GFERMPOCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL4963649 | 0.84 | MPO (0.56) | GFERMPOCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL4387868 | 0.83 | HTR2A (0.55) | GFERMPOCYP3A4CYP2D6HTR2A | |
| SCHEMBL4383376 | 0.81 | HTR1A (0.52) | GFERMPOCYP3A4CYP2D6HTR2A | |
| SCHEMBL4387861 | 0.79 | HTR1A (0.64) | GFERMPOCYP3A4CYP2D6HTR1D | |
| SCHEMBL4388061 | 0.79 | HTR2A (0.64) | GFERMPOCYP3A4CYP1A2CYP2D6 | |
| SCHEMBL735189 | 0.78 | MPO (0.79) | MPOCYP3A4CYP1A2CYP2D6CYP2A6 | |
| SCHEMBL29532652 | 0.78 | MPO (0.79) | MPOCYP3A4CYP1A2CYP2D6CYP2A6 | |
| SCHEMBL5307941 | 0.78 | TUBB4A (0.77) | GFERCYP3A4CYP2A6TUBB4ATUBB |
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-1893575-A2 | 2-(1H-INDOLYLSULFANYL)-ARYL AMINE DERIVATIVES | H.Lundbeck A/S (DK) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006134499-A2 | 2-(1H-INDOLYLSULFANYL)-ARYL AMINE DERIVATIVES | H. LUNDBECK A/S (DK) | 2006-12-21 | — | — | WO | disclosed |