Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 9/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.57 |
| ▸ | NPC1 | O15118 | 7/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.57 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | MPL | P40238 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 8/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.47 |
| ▸ | FEN1 | P39748 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.47 |
| ▸ | RELA | Q04206 | 2/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19626497 | 0.86 | ALDH1A1 (0.49) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL19625367 | 0.83 | CYP3A4 (0.40) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL126685 | 0.77 | MPL (0.69) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL172198 | 0.76 | LTA4H (0.54) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL1689576 | 0.76 | RAB9A (0.66) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL17626112 | 0.76 | CYP3A4 (0.43) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL29085894 | 0.76 | RAB9A (0.65) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| Bromide SCHEMBL6832827 | 0.75 | RAB9A (0.56) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL25242184 | 0.73 | RAB9A (0.61) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 | |
| SCHEMBL2762257 | 0.73 | MPL (0.63) | RAB9AALDH1A1NPC1SMN1; SMN2MEN1 |
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-2011132017-A1 | PYRIDO[3,4-D]PYRIMIDINYL ACETAMIDE DERIVATIVES AS TRPA1 MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2011-10-27 | — | — | WO | disclosed |