Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | QDPR | P09417 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17844399 | 0.83 | MAPT (0.37) | ALDH1A1SMN1; SMN2MAPTKDM4ETSHR | |
| SCHEMBL17838003 | 0.83 | GRM1 (0.50) | GRM5GRM1 | |
| SCHEMBL17844401 | 0.82 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2MAPTKDM4ETSHR | |
| SCHEMBL29668566 | 0.72 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2MAPTKDM4ETSHR | |
| SCHEMBL17844398 | 0.72 | TRPV1 (0.40) | ALDH1A1SMN1; SMN2MAPTKDM4ETSHR | |
| SCHEMBL17837379 | 0.72 | GRM1 (0.48) | GRM5GRM1 | |
| SCHEMBL28538259 | 0.70 | NAMPT (0.39) | ALDH1A1SMN1; SMN2KDM4ETSHRMEN1 | |
| SCHEMBL21045816 | 0.70 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPTTSHRHPGD | |
| SCHEMBL27762102 | 0.70 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2MAPTKDM4ETSHR | |
| SCHEMBL29924281 | 0.70 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2MAPTKDM4ETSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3233829-A1 | PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS | Pfizer Inc (US) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016097918-A1 | PYRIMIDINE AND TRIAZINE DERIVATIVES AND THEIR USE AS AXL INHIBITORS | PFIZER INC. (US) | 2016-06-23 | — | — | WO | disclosed |