Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | RECQL | P46063 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7902379 | 0.91 | ALDH1A1 (0.50) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL27952716 | 0.85 | ALDH1A1 (0.63) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL1342303 | 0.85 | ALDH1A1 (0.63) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL3043522 | 0.82 | ALDH1A1 (0.59) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL27829640 | 0.82 | ALDH1A1 (0.59) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL10666114 | 0.82 | ALDH1A1 (0.59) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL10583683 | 0.82 | ALDH1A1 (0.65) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL14476702 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL14460830 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TDP1NPC1RAB9ARECQL | |
| SCHEMBL8477414 | 0.81 | ALDH1A1 (0.58) | ALDH1A1TDP1NPC1RAB9ARECQL |
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-2003026666-A1 | 2-PHENYLAMINO-4- (5-PYRAZOLYLAMINO)-PYRIMIDINE DERIVATIVES AS KINASE INHIBITORS, IN PARTICULAR, AS SRC KINASE INHIBITORS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-04-03 | — | — | WO | disclosed |