Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | TDO2 | P48775 | 3/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27667303 | 0.78 | CYP2A6 (0.38) | MAPK1CYP2A6CYP2C19 | |
| SCHEMBL3903562 | 0.75 | TSHR (0.48) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL25204651 | 0.75 | TSHR (0.48) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL7523428 | 0.71 | TSHR (0.44) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL678428 | 0.70 | ADRB2 (0.59) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL1573440 | 0.69 | TSHR (0.60) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL7562082 | 0.69 | TSHR (0.60) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL197810 | 0.69 | ADRB2 (0.65) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL4445207 | 0.67 | ADRB2 (0.62) | TSHRHIF1AMAPK1TDP1ADRB2 | |
| SCHEMBL6190849 | 0.67 | TSHR (0.50) | TSHRHIF1AMAPK1TDP1ADRB2 |
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-1980896-A | Scalable synthesis of imidazole derivatives | JANSSEN PHARMACEUTICA NV (BE) | 2007-06-13 | — | — | CN | disclosed |