Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | CASP3 | P42574 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 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 | |
|---|---|---|---|---|
| SCHEMBL7297119 | 0.94 | NPC1 (0.48) | NPC1RAB9ACASP3MMP1MMP2 | |
| SCHEMBL8401492 | 0.91 | NPC1 (0.47) | NPC1RAB9ATRPV1CASP3LMNA | |
| SCHEMBL8401148 | 0.90 | TACR3 (0.46) | NPC1RAB9ACASP3KDM4EMMP1 | |
| SCHEMBL7292933 | 0.90 | MGLL (0.44) | NPC1RAB9ACASP3KDM4ELMNA | |
| SCHEMBL8403661 | 0.90 | TRPV1 (0.46) | NPC1RAB9ATRPV1CASP3MMP1 | |
| SCHEMBL8401224 | 0.89 | POLB (0.52) | NPC1RAB9ATRPV1CASP3POLB | |
| SCHEMBL8405271 | 0.87 | NPC1 (0.53) | NPC1RAB9ACASP3POLBPARP1 | |
| SCHEMBL8405847 | 0.86 | ELANE (0.45) | NPC1RAB9ACASP3ELANE | |
| SCHEMBL7294402 | 0.86 | NAMPT (0.47) | NPC1RAB9ACASP3LMNAPOLB | |
| SCHEMBL7293112 | 0.82 | HDAC3 (0.44) | NPC1RAB9ACASP3POLBSMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-5948785-A | USEFUL AS CHYMASE INHIBITORS AND CAN BE EFFECTIVE FOR THE PROPHYLAXIS AND TREATMENT OF VARIOUS DISEASES CAUSED BY CHYMASE, SUCH AS THOSE CAUSED BY ANGIOTENSIN II. | THE GREEN CROSS CORPORATION (JP) | 1999-09-07 | — | — | US | disclosed |