Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPM1B | O75688 | 1/20 | 0.54 |
| ▸ | IKBKB | O14920 | 1/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.46 |
| ▸ | CHUK | O15111 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | PRF1 | P14222 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3781502 | 0.86 | IKBKB (0.55) | PPM1BIKBKBESR2CHUKKMT2A | |
| SCHEMBL3793566 | 0.85 | IKBKB (0.73) | PPM1BIKBKBCHUKKMT2AMEN1 | |
| SCHEMBL6851164 | 0.85 | PPM1B (0.74) | PPM1BESR2HSD17B1KMT2AMEN1 | |
| SCHEMBL164897 | 0.84 | CA12 (0.46) | PPM1BIKBKBKMT2AMEN1KDM4E | |
| SCHEMBL7281430 | 0.79 | MKNK2 (0.58) | IKBKBESR2HSD17B1CHUKESR1 | |
| SCHEMBL3784526 | 0.78 | IKBKB (0.54) | PPM1BIKBKBMEN1PRF1MKNK1 | |
| SCHEMBL23499274 | 0.75 | PPM1B (0.79) | PPM1BIKBKBESR2KMT2AMEN1 | |
| SCHEMBL29908977 | 0.75 | PPM1B (0.79) | PPM1BIKBKBESR2KMT2AMEN1 | |
| SCHEMBL7064896 | 0.75 | ESR1 (0.43) | ESR2HSD17B1CHUKESR1KDM4E | |
| SCHEMBL20788509 | 0.75 | IKBKB (0.55) | IKBKBESR2CHUKESR1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-104955826-A | SPIRO-QUINAZOLINONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEUROLOGICAL DISEASES AND CONDITIONS | MERCK PATENT GMBH | 2015-09-30 | — | — | CN | disclosed |