Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.83 |
| ▸ | RAB9A | P51151 | 2/20 | 0.75 |
| ▸ | NPC1 | O15118 | 1/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.69 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.68 |
| ▸ | LMNA | P02545 | 3/20 | 0.67 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.66 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.65 |
| ▸ | MAPT | P10636 | 1/20 | 0.65 |
| ▸ | HTT | P42858 | 3/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.63 |
| ▸ | XBP1 | P17861 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL7258078 | 0.93 | HPGD (0.83) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL69310 | 0.91 | HPGD (1.00) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL7256405 | 0.87 | NPSR1 (0.79) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL11829885 | 0.84 | ALDH1A1 (1.00) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL1450411 | 0.84 | HPGD (0.80) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL94986 | 0.84 | ALDH1A1 (0.85) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL16453791 | 0.83 | HPGD (0.77) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL26125904 | 0.83 | ALDH1A1 (0.68) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| Pyrrole SCHEMBL9108828 | 0.82 | HPGD (0.81) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 | |
| SCHEMBL7258145 | 0.82 | HPGD (0.76) | HPGDRAB9ANPC1ALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003035614-A2 | TYROSINE KINASE INHIBITORS | MERCK & CO., INC. (US) | 2003-05-01 | — | — | WO | disclosed |