Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 8/20 | 0.76 |
| ▸ | GABRA5 | P31644 | 8/20 | 0.76 |
| ▸ | GABRA2 | P47869 | 8/20 | 0.76 |
| ▸ | GABRB2 | P47870 | 7/20 | 0.76 |
| ▸ | GABRA3 | P34903 | 7/20 | 0.76 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.45 |
| ▸ | PTAFR | P25105 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11104545 | 0.92 | GABRA1 (0.73) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11603285 | 0.91 | GABRA1 (0.74) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11604427 | 0.91 | GABRA1 (0.74) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11607591 | 0.90 | GABRA3 (0.70) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL7425412 | 0.90 | GABRA1 (0.73) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11838585 | 0.89 | GABRA3 (0.69) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11838601 | 0.89 | GABRA1 (0.71) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11606208 | 0.88 | GABRA3 (0.68) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL11804368 | 0.88 | GABRA3 (0.68) | GABRA1GABRA5GABRA2GABRB2GABRA3 | |
| SCHEMBL10747495 | 0.88 | GABRA1 (0.70) | GABRA1GABRA5GABRA2GABRB2GABRA3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4044016-A | ANTICONVULSANTS, SEDATIVES, MUSCLE RELAXANTS | HOFFMANN-LA ROCHE INC. (US) | 1977-08-23 | — | — | US | disclosed |
| US-4044129-A | CENTRAL NERVOUS SYSTEM, MUSCLE RELAXANTS, SEDATIVES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-08-23 | — | — | US | disclosed |
| US-4013763-A | MUSCLE RELAXANTS, ANTICONVULSANTS, SEDATIVES, TRANQUILIZERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JA) | 1977-03-22 | — | — | US | disclosed |
| US-3970664-A | ANTICONVULSANT, MUSCLE RELAXANT, SEDATIVE | HOFFMANN-LA ROCHE INC. (US) | 1976-07-20 | — | — | US | disclosed |
| US-3954728-A | ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES | HOFFMAN-LA ROCHE INC. (US) | 1976-05-04 | — | — | US | disclosed |