Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 4/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | CHUK | O15111 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | IL4 | P05112 | 1/20 | 0.40 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3783457 | 0.83 | KDM4E (0.48) | ADORA1ADORA2AKDM4EALDH1A1GAA | |
| SCHEMBL15214839 | 0.83 | NPSR1 (0.33) | ADORA1ADORA2AKDM4EALDH1A1HPGD | |
| SCHEMBL1905542 | 0.83 | ADORA1 (0.46) | ADORA1ADORA2AKDM4EALDH1A1GAA | |
| SCHEMBL6236169 | 0.82 | ADORA1 (0.47) | ADORA1ADORA2AKDM4EALDH1A1GAA | |
| SCHEMBL10226576 | 0.79 | CYP2A6 (0.42) | KDM4EALDH1A1SMN1; SMN2HPGDCHUK | |
| SCHEMBL22283897 | 0.79 | ADORA1 (0.51) | ADORA1ADORA2AKDM4EALDH1A1GAA | |
| SCHEMBL18269174 | 0.79 | ADORA1 (0.35) | ADORA1ADORA2AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL4482253 | 0.76 | IKBKB (0.47) | ALDH1A1GAAHPGDMEN1MAPT | |
| SCHEMBL2618362 | 0.76 | MEN1 (0.44) | ADORA1ADORA2AALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL7026138 | 0.72 | AS3MT (0.54) | GAASMN1; SMN2MAPTSQOR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1046731-C | Pyrrolo [2,3-d ] pyrimidines and their use | NOVARTIS AG (CH) | 1999-11-24 | — | — | CN | disclosed |
| CN-1164234-A | Pyrrolo [2, 3-d ] pyrimidines and their use | NOVARTIS AG (CH) | 1997-11-05 | — | — | CN | disclosed |