Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.38 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.38 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.38 |
| ▸ | CSF1R | P07333 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | NNMT | P40261 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1095488 | 0.79 | HTT (0.42) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL28952989 | 0.76 | DGAT1 (0.41) | KDM4EALDH1A1HPGDPARP10PARP15 | |
| SCHEMBL6736165 | 0.74 | PARP10 (0.48) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL12515332 | 0.73 | CYP3A4 (0.52) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL1299376 | 0.73 | CYP3A4 (0.37) | KDM4EALDH1A1HTTLMNATSHR | |
| SCHEMBL16974741 | 0.72 | L3MBTL1 (0.42) | KDM4EALDH1A1GAAHTTLMNA | |
| SCHEMBL29406733 | 0.71 | PIN1 (0.50) | ALDH1A1GAAHPGDHTTLMNA | |
| SCHEMBL1327202 | 0.71 | PIN1 (0.50) | ALDH1A1GAAHPGDHTTLMNA | |
| SCHEMBL2351921 | 0.71 | RAB9A (0.37) | ALDH1A1HTTLMNAMEN1KMT2A | |
| SCHEMBL28285146 | 0.71 | CYP3A4 (0.61) | KDM4EALDH1A1GLAGAAHPGD |
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-117042769-A | Substituted pyrrolopyrimidines and pyrazolopyrimidines as Bruton's Tyrosine Kinase (BTK) degrading agents | 冰洲石生物科技公司 | 2023-11-10 | — | — | CN | disclosed |