Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 2/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KHK | P50053 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30241198 | 0.92 | KDM4E (0.52) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL145984 | 0.92 | KDM4E (0.52) | KDM4EALDH1A1USP2LMNAMAPT | |
| Hydrochloric Acid SCHEMBL2482616 | 0.90 | KDM4E (0.50) | KDM4EALDH1A1USP2LMNAMAPT | |
| Fluoromethane SCHEMBL28180626 | 0.88 | KDM4E (0.53) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL21497154 | 0.81 | CYP11B1 (0.49) | ALDH1A1CYP3A4CYP11B1CYP11B2TDP1 | |
| SCHEMBL74807 | 0.79 | TRPV4 (0.46) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1514274 | 0.76 | CYP11B1 (0.57) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL1156401 | 0.75 | TRPV4 (0.57) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL30084909 | 0.75 | TRPV4 (0.57) | KDM4EALDH1A1USP2LMNAMAPT | |
| SCHEMBL30084906 | 0.75 | TRPV4 (0.57) | KDM4EALDH1A1USP2LMNAMAPT |
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-109790168-A | SUBSTITUTED PYRROLIZINE COMPOUNDS AND USES THEREOF | 吉利德科学公司 | 2019-05-21 | — | — | CN | disclosed |