Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 5/20 | 0.33 |
| ▸ | MMP2 | P08253 | 3/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | CETP | P11597 | 1/20 | 0.32 |
| ▸ | RORC | P51449 | 2/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8648378 | 1.00 | CYP3A4 (0.36) | CYP3A4ALDH1A1CYP2C9HPGDCYP2C19 | |
| SCHEMBL8647994 | 0.97 | ELANE (0.37) | CYP3A4ALDH1A1CYP2C9HPGDCYP2C19 | |
| SCHEMBL8649502 | 0.90 | GRM2 (0.33) | CYP3A4CYP2C19ELANECA2MMP13 | |
| SCHEMBL8649149 | 0.90 | ELANE (0.43) | CYP3A4ALDH1A1CYP2C9HPGDCYP2C19 | |
| SCHEMBL8643860 | 0.90 | ELANE (0.43) | CYP3A4ALDH1A1CYP2C9HPGDCYP2C19 | |
| SCHEMBL8324994 | 0.89 | ELANE (0.41) | CYP3A4ELANECA2MMP13MMP2 | |
| SCHEMBL8648346 | 0.85 | PSEN1 (0.40) | ALDH1A1CYP2C9HPGDCYP2C19GRM2 | |
| SCHEMBL8646696 | 0.85 | PSEN1 (0.40) | ALDH1A1CYP2C9HPGDCYP2C19GRM2 | |
| SCHEMBL8643777 | 0.85 | ELANE (0.47) | ALDH1A1ELANECA2MMP13MMP2 | |
| SCHEMBL8325779 | 0.85 | ELANE (0.44) | CYP3A4ELANECA2MMP13LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5824824-A | AROMATIC SULFONATE ANIONS AND DISSOLUTION CONTRAST IN EXPOSED AND NONEXPOSED AREAS, POSITIVE RESISTS | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1998-10-20 | — | — | US | disclosed |