Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 2/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.32 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28149231 | 0.88 | CUL4A (0.38) | KMT2ASMN1; SMN2ELANESNCAKDM4E | |
| SCHEMBL15535373 | 0.81 | SNCA (0.41) | KMT2AESR1SNCAKDM4EALDH1A1 | |
| SCHEMBL15534930 | 0.81 | ALDH1A1 (0.43) | SMN1; SMN2SNCAKDM4EALDH1A1RAB9A | |
| SCHEMBL15535136 | 0.79 | PDE3B (0.45) | KMT2AESR1SNCAKDM4EALDH1A1 | |
| SCHEMBL15535010 | 0.78 | SNCA (0.43) | KMT2AESR1SNCAKDM4EALDH1A1 | |
| SCHEMBL15535465 | 0.78 | AR (0.42) | KMT2ASNCALMNA | |
| SCHEMBL15535458 | 0.78 | RXRA (0.43) | HIF1AAKR1B1SNCAKDM4EALDH1A1 | |
| SCHEMBL15536028 | 0.77 | ACACB (0.38) | KMT2AESR1HIF1ASMN1; SMN2SNCA | |
| SCHEMBL15535245 | 0.77 | SNCA (0.42) | KMT2AESR1SNCAKDM4EALDH1A1 | |
| SCHEMBL15535677 | 0.77 | ALDH1A1 (0.38) | SNCAKDM4EALDH1A1PDE3BPDE3A |
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-104334525-B | catechol O-methyltransferase activity inhibiting compounds | 奥赖恩公司 | 2017-05-10 | — | — | CN | disclosed |