Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ECE1 | P42892 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16377845 | 0.89 | CCNA2 (0.38) | KMT2AALDH1A1PPARGMAPK10NPSR1 | |
| SCHEMBL16339801 | 0.87 | CCNA2 (0.33) | CCNA2CDK2CCNA1 | |
| SCHEMBL22607636 | 0.83 | CCNA2 (0.35) | KMT2AALDH1A1NPSR1CCNA2CDK2 | |
| SCHEMBL16333638 | 0.81 | CCNA2 (0.39) | KMT2AALDH1A1CCNA2CDK2CCNA1 | |
| SCHEMBL17381996 | 0.81 | CCNA2 (0.46) | KMT2AALDH1A1CCNA2CDK2CCNA1 | |
| SCHEMBL30885869 | 0.81 | CCNA2 (0.39) | KMT2AALDH1A1CCNA2CDK2CCNA1 | |
| SCHEMBL17381608 | 0.81 | CCNA2 (0.39) | KMT2AALDH1A1CCNA2CDK2CCNA1 | |
| SCHEMBL17382365 | 0.80 | CCNA2 (0.39) | KMT2ACCNA2CDK2CCNA1MEN1 | |
| SCHEMBL16340134 | 0.77 | CCNA2 (0.37) | ALDH1A1CCNA2CDK2CCNA1L3MBTL1 | |
| SCHEMBL17783218 | 0.75 | PDE7A (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3013832-B1 | PYRAZOLE COMPOUNDS AS MODULATORS OF FSHR AND USES THEREOF | MERCK PATENT GMBH (DE) | 2020-11-04 | — | — | EP | disclosed |