Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | CASP3 | P42574 | 1/20 | 0.53 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA6 | P23280 | 1/20 | 0.52 |
| ▸ | CA7 | P43166 | 1/20 | 0.52 |
| ▸ | TPMT | P51580 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7356945 | 0.91 | NPC1 (0.53) | NPC1RAB9ACASP3SENP7SMN1; SMN2 | |
| SCHEMBL6073307 | 0.88 | MAPK1 (0.55) | NPC1RAB9ACASP3SENP7SMN1; SMN2 | |
| SCHEMBL9068671 | 0.86 | CA12 (0.59) | RAB9ACA12CA1CA2CA4 | |
| SCHEMBL2934121 | 0.86 | KDM4E (0.51) | NPC1RAB9ACASP3SENP7CA12 | |
| SCHEMBL17908114 | 0.85 | PTGER1 (0.56) | NPC1RAB9ACASP3SENP7SMN1; SMN2 | |
| SCHEMBL7389578 | 0.83 | PDE4B (0.60) | CA12CA1CA2CA4CA6 | |
| SCHEMBL12508471 | 0.82 | PDE4B (0.58) | CA12CA1CA2CA4CA6 | |
| SCHEMBL2814888 | 0.81 | SCN9A (0.54) | NPC1RAB9ACASP3SENP7SMN1; SMN2 | |
| SCHEMBL2814439 | 0.81 | SCN9A (0.54) | NPC1RAB9ACASP3SENP7SMN1; SMN2 | |
| SCHEMBL13125277 | 0.81 | NPC1 (0.56) | NPC1RAB9ACASP3SENP7SMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0741707-B1 | SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS | RHONE POULENC RORER LTD (GB) | 1998-04-01 | — | — | EP | disclosed |