Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HMGCR | P04035 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7470858 | 0.81 | CYP3A4 (0.39) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL1278020 | 0.80 | GAA (0.40) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL11085863 | 0.79 | CYP2C9 (0.38) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL16979607 | 0.79 | CYP3A4 (0.38) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL5575508 | 0.79 | CYP3A4 (0.38) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL8104064 | 0.79 | CYP3A4 (0.45) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL4922746 | 0.77 | GAA (0.38) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL13269359 | 0.76 | POLB (0.38) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL3311718 | 0.75 | HMGCR (0.41) | CYP2C9CYP2C19CYP3A4HMGCRGAA | |
| SCHEMBL8961381 | 0.75 | CYP3A4 (0.40) | CYP2C9CYP2C19CYP3A4HMGCRGAA |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0790994-B1 | HETEROCYCLE SUBSTITUTED PROPENOIC ACID DERIVATIVES AS NMDA ANTAGONISTS | AVENTIS PHARMA INC (US) | 2002-05-08 | — | — | EP | disclosed |
| US-6180786-B1 | ANTAGONIST FOR EXCITORY AMINO ACIDS | HOECHST MARION ROUSSEL, INC. | 2001-01-30 | — | — | US | disclosed |
| US-5981553-A | BLOCKING EXCITATORY AMINO ACID ACTION IN PREVENTING HUNTINGTON'S DISEASE, ALZHEIMER'S DISEASE, SENILE DEMENTIA, GLUTARIC ACIDAEMIA TYPE I, MULTI-INFARCT DEMENTIA, AMYOTROPHIC LATERAL SCLEROSIS OR NEURONAL DAMAGE FROM SEIZURES | HOECHST MARION ROUSSEL, INC. (US) | 1999-11-09 | — | — | US | disclosed |
| EP-0790994-A1 | HETEROCYCLE SUBSTITUTED PROPENOIC ACID DERIVATIVES AS NMDA ANTAGONISTS | HOECHST MARION ROUSSEL, INC. (US) | 1997-08-27 | — | — | EP | disclosed |
| US-5563157-A | EXCITATORY AMINO ACID ANTAGONISTS | HOECHST MARION ROUSSEL INC. (US) | 1996-10-08 | — | — | US | disclosed |
| US-5519048-A | 3-(indol-3-yl)-propenoic acid derivatives and pharmaceutical compositions thereof | MERRELL PHARMACEUTICALS INC. (US) | 1996-05-21 | — | — | US | disclosed |
| WO-1996013501-A1 | HETEROCYCLE SUBSTITUTED PROPENOIC ACID DERIVATIVES AS NMDA ANTAGONISTS | HOECHST MARION ROUSSEL, INC. (US) | 1996-05-09 | — | — | WO | disclosed |