Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 5/20 | 0.48 |
| ▸ | HTR2A | P28223 | 4/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8716705 | 0.94 | HSD11B1 (0.50) | ALDH1A1LMNASMN1; SMN2HTTHSD11B1 | |
| SCHEMBL8716646 | 0.90 | HTR2A (0.53) | ALDH1A1LMNAHSD11B1HTR2AHTR2C | |
| SCHEMBL8716522 | 0.89 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2HTTHSD11B1 | |
| Oxalic Acid SCHEMBL9230555 | 0.88 | HTR2A (0.53) | ALDH1A1LMNAHSD11B1HTR2AKMT2A | |
| Oxalic Acid SCHEMBL9232796 | 0.88 | HTR2A (0.53) | ALDH1A1LMNAHSD11B1HTR2AKMT2A | |
| SCHEMBL8716650 | 0.88 | PTGIR (0.52) | ALDH1A1LMNASMN1; SMN2HSD11B1HTR2A | |
| SCHEMBL8716772 | 0.86 | HSD11B1 (0.51) | ALDH1A1LMNASMN1; SMN2HTTHSD11B1 | |
| SCHEMBL8713259 | 0.86 | CYP2C19 (0.51) | ALDH1A1LMNASMN1; SMN2HTTHSD11B1 | |
| Fumaric Acid SCHEMBL9230591 | 0.84 | ALDH1A1 (0.49) | ALDH1A1LMNASMN1; SMN2HTTHSD11B1 | |
| Fumaric Acid SCHEMBL9230588 | 0.84 | ALDH1A1 (0.49) | ALDH1A1LMNASMN1; SMN2HTTHSD11B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5728835-A | HYPOTENSIVE AGENTS; ANTIISCHEMIC AGENTS | TOA EIYO, LTD. (JP) | 1998-03-17 | — | — | US | disclosed |
| EP-0661266-A1 | Substituted cyclic amine compounds as 5HT2 antagonists | TOA EIYO LTD. (JP) | 1995-07-05 | — | — | EP | disclosed |