Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.36 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.36 |
| ▸ | LSS | P48449 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL11271107 | 0.85 | MAPK10 (0.44) | MAPK10PARP1PARP10PARP11ALDH1A1 | |
| SCHEMBL11261829 | 0.85 | BRD4 (0.45) | NPC1TSHRRAB9ASMN1; SMN2MAPK10 | |
| SCHEMBL11251733 | 0.82 | ALDH1A1 (0.53) | MAPK10ALDH1A1MAOALMNA | |
| SCHEMBL1011370 | 0.73 | ALDH1A1 (0.47) | PARP1PARP10PARP11ALDH1A1MAOA | |
| SCHEMBL11259543 | 0.73 | MAPK10 (0.42) | MAPK10MAPK14 | |
| SCHEMBL8487986 | 0.70 | NOS2 (0.52) | TSHRPARP1PARP10PARP11ALDH1A1 | |
| SCHEMBL28176958 | 0.70 | PARP1 (0.42) | PARP1PARP10PARP11ALDH1A1CYP19A1 | |
| SCHEMBL28176951 | 0.70 | PARP1 (0.42) | PARP1PARP10PARP11ALDH1A1CYP19A1 | |
| SCHEMBL3056436 | 0.70 | ENPP1 (0.37) | PARP1PARP10PARP11ALDH1A1CYP11B1 | |
| SCHEMBL5467699 | 0.68 | CYP2A6 (0.42) | NPC1RAB9ASMN1; SMN2ALDH1A1HPGD |
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-4337256-A | ANTIINFLAMMATORY AGENTS; ANTIAGGLOMERANTS; ENZYME INHIBITORS; ANTIULCER AGENTS | TEIKOKU HORMONE MANUFACTURING CO., LTD. (JP) | 1982-06-29 | — | — | US | disclosed |
| EP-0013411-A1 | Isoquinoline derivatives, process for their preparation and pharmaceutical compositions containing them | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 1980-07-23 | — | — | EP | disclosed |