Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.32 |
| ▸ | HTR3B | O95264 | 2/20 | 0.32 |
| ▸ | HTR3A | P46098 | 2/20 | 0.32 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.32 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.30 |
| ▸ | MERTK | Q12866 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6110442 | 0.85 | THRA (0.33) | THRATHRBNPC1CYP1A2CYP2C9 | |
| SCHEMBL6109701 | 0.85 | ITGB1 (0.34) | HPGDSMN1; SMN2 | |
| SCHEMBL6108982 | 0.84 | AAK1 (0.33) | THRATHRBSMN1; SMN2 | |
| SCHEMBL6109839 | 0.83 | AAK1 (0.32) | THRATHRBSMN1; SMN2 | |
| SCHEMBL6109923 | 0.83 | THRA (0.32) | THRATHRBSMN1; SMN2 | |
| SCHEMBL6106931 | 0.81 | RXFP1 (0.33) | THRATHRBMEN1KMT2A | |
| SCHEMBL6108262 | 0.81 | ALDH1A1 (0.38) | NPC1CYP1A2HPGDCYP2C19SMN1; SMN2 | |
| SCHEMBL6106709 | 0.81 | ALDH1A1 (0.33) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL6111468 | 0.81 | MAPK8 (0.38) | MEN1KMT2A | |
| SCHEMBL6107056 | 0.80 | THRA (0.33) | THRATHRBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7034039-B2 | Fused heterocyclic compounds | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2006-04-25 | — | — | US | disclosed |