Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 13/20 | 0.64 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
| ▸ | HBB | P68871 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7303980 | 0.88 | PARP1 (0.60) | PARP1CASP1HBBKDM4EALDH1A1 | |
| SCHEMBL7308137 | 0.88 | PARP1 (0.60) | PARP1CASP1HBBKDM4EALDH1A1 | |
| SCHEMBL7302586 | 0.87 | PARP1 (0.75) | PARP1CASP1HBBKDM4EALDH1A1 | |
| SCHEMBL7303316 | 0.85 | PARP1 (0.64) | PARP1MAPTTDP1TSHRHTR1A | |
| Bromide SCHEMBL7303725 | 0.85 | PARP1 (0.63) | PARP1MAPTTDP1TSHRHTR1A | |
| SCHEMBL7305161 | 0.84 | PARP1 (0.73) | PARP1 | |
| SCHEMBL7307656 | 0.83 | PARP1 (0.63) | PARP1MAPTTDP1TSHRHTR1A | |
| SCHEMBL7302855 | 0.83 | PARP1 (0.64) | PARP1 | |
| SCHEMBL7308221 | 0.83 | PARP1 (0.63) | PARP1 | |
| Hydrochloric Acid SCHEMBL7301544 | 0.83 | PARP1 (0.63) | PARP1KDM4EMAPT |
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-5304560-A | Treating CNS disorders; dopamine receptor antagonist | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1994-04-19 | — | — | US | disclosed |
| EP-0481342-A1 | Quinazoline derivatives and their preparation | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1992-04-22 | — | — | EP | disclosed |