Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | ACLY | P53396 | 1/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
| ▸ | MMP12 | P39900 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3076696 | 1.00 | RAB9A (0.53) | RAB9ANPC1ACLYMMP1MMP2 | |
| SCHEMBL4955339 | 0.85 | L3MBTL1 (0.57) | ACLYALDH1A1MAPTHPGDHTT | |
| SCHEMBL4404890 | 0.83 | TRPM2 (0.49) | RAB9ANPC1ACLYMMP1MMP2 | |
| SCHEMBL4404884 | 0.83 | TRPM2 (0.49) | RAB9ANPC1ACLYMMP1MMP2 | |
| SCHEMBL27372484 | 0.81 | ALDH1A1 (0.57) | RAB9ANPC1ACLYMMP1MMP2 | |
| SCHEMBL27372482 | 0.81 | ALDH1A1 (0.57) | RAB9ANPC1ACLYMMP1MMP2 | |
| SCHEMBL10874779 | 0.79 | NPC1 (0.68) | RAB9ANPC1LMNAALDH1A1MAPT | |
| SCHEMBL27513654 | 0.79 | ACLY (0.53) | ACLYMMP1MMP2MMP9MMP12 | |
| SCHEMBL9597291 | 0.79 | ACLY (0.53) | RAB9ANPC1ACLYMMP1MMP2 | |
| SCHEMBL2233522 | 0.77 | NPC1 (0.69) | RAB9ANPC1LMNAALDH1A1KDM4E |
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-7795166-B2 | Functional group-selective hydrogenation catalyst and functional group-selective hydrogenation method | N.E. CHEMCAT CORPORATION (JP) | 2010-09-14 | — | — | US | disclosed |
| US-20070155617-A1 | FUNCTIONAL GROUP-SELECTIVE HYDROGENATION CATALYST AND FUNCTIONAL GROUP-SELECTIVE HYDROGENATION METHOD | N. E. CHEMCAT CORPORATION (JP) | 2007-07-05 | — | — | US | disclosed |