Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | EED | O75530 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2173793 | 0.86 | SRC (0.42) | SRCMAOAMAOBCHRNB4CHRNA3 | |
| SCHEMBL7819927 | 0.85 | ALDH1A3 (0.51) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7832269 | 0.81 | SLC6A2 (0.46) | SLC6A2SLC6A4SLC6A3CYP2D6EED | |
| SCHEMBL5728995 | 0.77 | SLC6A3 (0.45) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL599867 | 0.73 | ALDH1A3 (0.60) | SRCMAOAMAOBNPC1GAA | |
| SCHEMBL29951428 | 0.73 | ALDH1A3 (0.60) | SRCMAOAMAOBNPC1GAA | |
| SCHEMBL3184582 | 0.72 | SLC6A2 (0.37) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL17687784 | 0.72 | PIM2 (0.36) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL17687817 | 0.72 | PIM2 (0.36) | SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL7819920 | 0.72 | GRM2 (0.36) | SLC6A2SLC6A4SLC6A3NPC1HPGD |
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-1102753-A2 | PYRAZOLES AS ESTROGEN RECEPTOR MODULATORS | CHIRON CORPORATION (US) | 2001-05-30 | — | — | EP | disclosed |
| WO-2000007996-A2 | PYRAZOLES AS ESTROGEN RECEPTOR MODULATORS | CHIRON CORPORATION (US) | 2000-02-17 | — | — | WO | disclosed |