Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.35 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 5/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL864318 | 0.84 | CYP1A2 (0.47) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| SCHEMBL787731 | 0.84 | ALDH1A1 (0.39) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| SCHEMBL9203703 | 0.83 | CYP1A2 (0.42) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| SCHEMBL5841650 | 0.81 | PLA2G2C (0.43) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| SCHEMBL17782328 | 0.81 | PLA2G2C (0.43) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| Oxalic Acid SCHEMBL5022544 | 0.79 | CYP1A2 (0.39) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| Oxalic Acid SCHEMBL1376933 | 0.78 | PLA2G2C (0.35) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| SCHEMBL371423 | 0.77 | GABBR2 (0.42) | MEN1CYP1A2KMT2AGABBR2GABBR1 | |
| SCHEMBL779433 | 0.77 | TRPM8 (0.45) | GABBR2GABBR1S1PR2S1PR4S1PR1 | |
| SCHEMBL2118428 | 0.76 | LAP3 (0.38) | ANPEPMEN1CYP1A2KMT2AGABBR2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0496561-B1 | [[(2-Amino-3,4-dioxo-1-cyclobuten-1-yl)amino]alkyl]-acid derivatives | AMERICAN HOME PROD (US) | 1995-03-15 | — | — | EP | disclosed |
| US-5240946-A | Anticonvulsants, nervous system disorders | AMERICAN HOME PRODUCTS CORPORATION (US) | 1993-08-31 | — | — | US | disclosed |
| US-5168103-A | Neuroprotectants, anticonvulsants | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-12-01 | — | — | US | disclosed |
| EP-0496561-A2 | [[(2-Amino-3,4-dioxo-1-cyclobuten-1-yl)amino]alkyl]-acid derivatives | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-07-29 | — | — | EP | disclosed |