Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.40 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | F7 | P08709 | 1/20 | 0.38 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.37 |
| ▸ | DAO | P14920 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | EIF4A3 | P38919 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28053972 | 0.90 | GPR35 (0.40) | PIN1GPR35SMAD3KDM4EHPGD | |
| SCHEMBL28053753 | 0.75 | DAO (0.36) | PIN1GPR35SMAD3KDM4EHPGD | |
| SCHEMBL28225483 | 0.74 | EIF4A3 (0.49) | PIN1GPR35SMAD3KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL28226226 | 0.73 | EIF4A3 (0.48) | PIN1GPR35SMAD3KDM4EHPGD | |
| SCHEMBL28053905 | 0.72 | GPR35 (0.40) | GPR35KDM4EALDH1A1LMNADAO | |
| SCHEMBL2107838 | 0.71 | PIN1 (0.56) | PIN1GPR35SMAD3KDM4EHPGD | |
| SCHEMBL31733036 | 0.71 | PIN1 (0.51) | PIN1GPR35SMAD3KDM4EHPGD | |
| SCHEMBL2320949 | 0.71 | PIN1 (0.51) | PIN1GPR35SMAD3KDM4EHPGD | |
| SCHEMBL5833448 | 0.69 | HCAR3 (0.58) | GPR35SMAD3KDM4EHPGDHSD17B10 | |
| SCHEMBL4397741 | 0.68 | KDM4E (0.56) | PIN1GPR35SMAD3KDM4EHPGD |
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-105283443-A | Heterocyclic derivatives and use thereof | C & C RES LAB | 2016-01-27 | — | — | CN | disclosed |