Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | NPC1 | O15118 | 3/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9588889 | 0.87 | NPC1 (0.70) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL15516309 | 0.81 | NPC1 (0.66) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL111605 | 0.81 | ALDH1A1 (0.68) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL1871761 | 0.81 | ALDH1A1 (0.68) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL1163050 | 0.80 | NPC1 (0.64) | RAB9ANPC1ALDH1A1MAPTCASP3 | |
| SCHEMBL4291027 | 0.80 | NPC1 (0.64) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL3083502 | 0.80 | NPC1 (0.60) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL5853278 | 0.80 | NPC1 (1.00) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| Hydrochloric Acid SCHEMBL27438937 | 0.79 | ALDH1A1 (0.66) | RAB9ANPC1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL27168266 | 0.79 | ALDH1A1 (0.66) | RAB9ANPC1ALDH1A1L3MBTL1MAPT |
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 |