Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 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 | |
|---|---|---|---|---|
| SCHEMBL31347314 | 0.83 | BPTF (0.41) | HTR2CTSHRHSD11B1POLB | |
| SCHEMBL22650563 | 0.83 | BPTF (0.41) | HTR2CTSHRHSD11B1POLB | |
| SCHEMBL310055 | 0.81 | SUV39H2 (0.45) | ALDH1A1CYP3A4TSHRHSD17B10TDP1 | |
| SCHEMBL29661369 | 0.81 | SUV39H2 (0.45) | ALDH1A1CYP3A4TSHRHSD17B10TDP1 | |
| Hydrochloric Acid SCHEMBL29367159 | 0.80 | SUV39H2 (0.44) | ALDH1A1CYP3A4TSHRHSD17B10TDP1 | |
| SCHEMBL22650565 | 0.79 | DDB1 (0.38) | ALDH1A1TSHRHSD17B10POLBHTT | |
| SCHEMBL14240636 | 0.79 | NTSR1 (0.47) | MCHR1ALDH1A1CYP3A4TSHRHSD17B10 | |
| SCHEMBL520746 | 0.79 | NTSR1 (0.47) | MCHR1ALDH1A1CYP3A4TSHRHSD17B10 | |
| SCHEMBL20091850 | 0.75 | CHEK1 (0.60) | LMNACHEK1ALDH1A1CYP3A4TSHR | |
| SCHEMBL10206636 | 0.75 | ALK (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |