Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDGFRB | P09619 | 1/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | BCL9 | O00512 | 1/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 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 | |
|---|---|---|---|---|
| SCHEMBL28847483 | 0.93 | CA2 (0.43) | PDGFRBPDGFRACA2KMT2ALMNA | |
| SCHEMBL30637066 | 0.76 | MMP12 (0.56) | KDM4EKMT2AALDH1A1RAB9ALMNA | |
| SCHEMBL558123 | 0.76 | MMP12 (0.56) | KDM4EKMT2AALDH1A1RAB9ALMNA | |
| SCHEMBL15595099 | 0.72 | ATP4A (0.47) | KDM4EKMT2AALDH1A1RAB9ALMNA | |
| SCHEMBL29687140 | 0.72 | PDGFRB (0.48) | PDGFRBPDGFRACA2BCL9CTNNB1 | |
| SCHEMBL27493245 | 0.72 | CA2 (0.56) | PDGFRBPDGFRACA2BCL9CTNNB1 | |
| SCHEMBL14677003 | 0.72 | MAOB (0.44) | KDM4EALDH1A1RAB9ALMNASMYD3 | |
| SCHEMBL19926335 | 0.71 | SMYD3 (0.44) | KDM4EGAAALDH1A1RAB9ALMNA | |
| SCHEMBL29875074 | 0.71 | SMYD3 (0.44) | KDM4EGAAALDH1A1RAB9ALMNA | |
| SCHEMBL2619124 | 0.71 | MAPKAPK2 (0.50) | GAAKMT2AALDH1A1RAB9ASMYD3 |
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-109890822-A | INHIBITORS OF CELLULAR METABOLIC PROCESSES | 安吉奥斯医药品有限公司 | 2019-06-14 | — | — | CN | disclosed |