Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | KIF11 | P52732 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23527389 | 0.89 | TSHR (0.41) | CYP1A2ALDH1A1TSHRTDP1KIF11 | |
| SCHEMBL21850748 | 0.87 | MAOA (0.41) | CYP1A2ALDH1A1TSHRTDP1KIF11 | |
| SCHEMBL21850735 | 0.87 | POLB (0.32) | CYP1A2ALDH1A1TSHRTDP1KIF11 | |
| SCHEMBL17914397 | 0.87 | ATM (0.33) | CYP1A2ALDH1A1TSHRTDP1KIF11 | |
| SCHEMBL18473339 | 0.83 | ACHE (0.47) | ALDH1A1TDP1MAPK1KDM4ESMN1; SMN2 | |
| SCHEMBL24859351 | 0.81 | ALDH1A1 (0.44) | CYP1A2ALDH1A1TSHRTDP1KDM4E | |
| SCHEMBL22159824 | 0.81 | PADI4 (0.47) | CYP1A2ALDH1A1TSHRTDP1KDM4E | |
| SCHEMBL12743233 | 0.79 | MEN1 (0.39) | ALDH1A1KIF11MAPK1SMN1; SMN2CYP2A6 | |
| SCHEMBL1102538 | 0.79 | MAOA (0.42) | CYP1A2ALDH1A1TSHRTDP1KIF11 | |
| SCHEMBL13222013 | 0.79 | ATM (0.55) | CYP1A2ALDH1A1TSHRTDP1KDM4E |
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-117866017-A | Organometallic compound, light-emitting device, electronic device, and electronic apparatus | 三星显示有限公司 | 2024-04-12 | — | — | CN | disclosed |