Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 4/20 | 0.39 |
| ▸ | CES1 | P23141 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | DBH | P09172 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 2/20 | 0.36 |
| ▸ | DDO | Q99489 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27612607 | 0.85 | CA3 (0.43) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL681911 | 0.79 | GABRA1 (0.48) | PTGS1CA3CA6CA5ACA9 | |
| SCHEMBL27634469 | 0.79 | CES2 (0.38) | CES2CES1RECQLPSEN1PSEN2 | |
| SCHEMBL28372343 | 0.79 | APP (0.43) | PTGS1PTGS2KDM4EALDH1A1LMNA | |
| SCHEMBL29740596 | 0.79 | APP (0.43) | PTGS1PTGS2KDM4EALDH1A1LMNA | |
| SCHEMBL3309885 | 0.78 | CA3 (0.43) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL16946707 | 0.78 | CA3 (0.43) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL27502850 | 0.77 | MEN1 (0.53) | PTGS1PTGS2KDM4EGAAHSP90AA1 | |
| SCHEMBL27506947 | 0.77 | HPGD (0.48) | PTGS1PTGS2CES2KDM4EGAA | |
| SCHEMBL27716929 | 0.77 | RNASEH1 (0.52) | PTGS1PTGS2CA5ACA9KDM4E |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110317213-A | The huge ring of the diaryl of regulator as protein kinase | 特普医药公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-110317214-A | The huge ring of the diaryl of regulator as protein kinase | 特普医药公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-106170289-B | Diaryl macrocycles as modulators of protein kinases | 特普医药公司 | 2019-07-23 | — | — | CN | disclosed |
| CN-106170289-A | Diaryl macrocycles as modulators of protein kinases | TP生物医药公司 | 2016-11-30 | — | — | CN | disclosed |
| CN-101855224-B | Equilibrative nucleoside transporter ENT1 inhibitors | JANSSEN PHARMACEUTICA NV | 2012-11-28 | — | — | CN | disclosed |
| CN-101855224-A | Equilibrative nucleoside transporter ENT 1 inhibitors | JANSSEN PHARMACEUTICA NV | 2010-10-06 | — | — | CN | disclosed |
| CN-101627007-A | Aminoamides as orexin antagonists | HOFFMANN LA ROCHE | 2010-01-13 | — | — | CN | disclosed |
| CN-1228330-C | Imidazole derivatives or their salts | SSP CO LTD (JP) | 2005-11-23 | — | — | CN | disclosed |
| CN-1462270-A | Imidazole derivatives or their salts | SSP CO LTD (JP) | 2003-12-17 | — | — | CN | disclosed |