Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP14 | Q460N5 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.35 |
| ▸ | PRKDC | P78527 | 1/20 | 0.35 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | F9 | P00740 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23300727 | 0.91 | PARP14 (0.46) | PARP14ALOX5KDM4EALDH1A1MAPK1 | |
| SCHEMBL23330327 | 0.87 | KDM4E (0.36) | KDM4EALDH1A1MAPK1HPGDNPC1 | |
| SCHEMBL29831414 | 0.87 | CYP1A2 (0.49) | PARP14ALOX5RAB9ASMN1; SMN2LMNA | |
| SCHEMBL23330828 | 0.87 | CYP1A2 (0.49) | PARP14ALOX5RAB9ASMN1; SMN2LMNA | |
| SCHEMBL23300916 | 0.83 | ERN1 (0.43) | KDM4EALDH1A1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL29831249 | 0.83 | CYP2C19 (0.47) | KDM4EALDH1A1HTTSMN1; SMN2LMNA | |
| SCHEMBL24932420 | 0.83 | ALOX5 (0.48) | PARP14ALOX5CYP1A2PRKDCF9 | |
| SCHEMBL23330455 | 0.83 | CYP2C19 (0.47) | KDM4EALDH1A1HTTSMN1; SMN2LMNA | |
| SCHEMBL23330457 | 0.82 | POLQ (0.37) | KDM4EALDH1A1NPC1RAB9ALMNA | |
| SCHEMBL29832289 | 0.82 | POLQ (0.37) | KDM4EALDH1A1NPC1RAB9ALMNA |
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-112724127-B | Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof | 中国科学院上海药物研究所 | 2023-02-17 | — | — | CN | disclosed |
| CN-114829357-A | Five-membered heterocyclic oxocarboxylic acid compound and medical application thereof | 中国科学院上海药物研究所 | 2022-07-29 | — | — | CN | disclosed |