Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | ALB | P02768 | 1/20 | 0.51 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | TACR1 | P25103 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30438111 | 1.00 | LMNA (0.52) | LMNAPOLBCYP2C9KDM4EALDH1A1 | |
| SCHEMBL109205 | 0.98 | LMNA (0.53) | LMNAPOLBCYP2C9KDM4EALDH1A1 | |
| SCHEMBL15156165 | 0.88 | CYP2C9 (0.50) | LMNAPOLBCYP2C9KDM4EALDH1A1 | |
| SCHEMBL2889577 | 0.85 | TDP1 (0.60) | LMNACYP2C9KMT2AMEN1MAPT | |
| SCHEMBL2889581 | 0.85 | TDP1 (0.60) | LMNACYP2C9KMT2AMEN1MAPT | |
| SCHEMBL13559962 | 0.82 | GABBR2 (0.53) | CYP2C9KDM4EALDH1A1KMT2AALB | |
| SCHEMBL11254513 | 0.82 | CTSA (0.49) | LMNAPOLBCYP2C9KDM4EALDH1A1 | |
| SCHEMBL14509741 | 0.81 | CYP2C9 (0.50) | LMNACYP2C9KDM4EALDH1A1KMT2A | |
| SCHEMBL108988 | 0.80 | ESR1 (0.48) | LMNACYP2C9KDM4EALDH1A1KMT2A | |
| SCHEMBL1149769 | 0.80 | FFAR1 (0.53) | POLBKDM4EALDH1A1MAPTHPGD |
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-116507695-A | Aromatic isothiocyanates | 默克专利股份有限公司 | 2023-07-28 | — | — | CN | disclosed |