Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12146428 | 0.83 | KMT2A (0.51) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL18305076 | 0.80 | KMT2A (0.49) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL20511832 | 0.80 | KMT2A (0.49) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL14572003 | 0.73 | ALDH1A1 (0.49) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL2759541 | 0.73 | ALDH1A1 (0.53) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL266148 | 0.71 | KMT2A (0.58) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL25025341 | 0.71 | KDM4E (0.43) | ALDH1A1KMT2AMAPK1MEN1KDM4E | |
| SCHEMBL20053799 | 0.70 | KDM4E (0.49) | ALDH1A1KMT2AKDM4EHSD17B10GAA | |
| SCHEMBL12256565 | 0.70 | NPSR1 (0.46) | ALDH1A1KDM4ENPSR1HSD17B10GAA | |
| SCHEMBL14218859 | 0.70 | NPSR1 (0.46) | ALDH1A1KDM4ENPSR1HSD17B10GAA |
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 |
|---|---|---|---|---|---|---|---|
| US-9914740-B2 | Tricyclic pyrido-carboxamide derivatives as rock inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-03-13 | — | — | US | disclosed |