Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11080968 | 0.78 | GSK3B (0.53) | GSK3BCES1TDP1ALDH1A1PKM | |
| SCHEMBL671514 | 0.78 | GSK3B (0.67) | GSK3BCA1CA2MAPK1CES1 | |
| SCHEMBL11510574 | 0.77 | GSK3B (0.71) | GSK3BCA1CA2MAPK1CES1 | |
| SCHEMBL240086 | 0.77 | GSK3B (0.71) | GSK3BCA1CA2MAPK1CES1 | |
| SCHEMBL11080976 | 0.77 | GSK3B (0.53) | GSK3BCA1CA2CES1TSHR | |
| SCHEMBL10350150 | 0.77 | CA1 (0.52) | CA1CA2CES1TSHRALDH1A1 | |
| SCHEMBL220960 | 0.76 | GSK3B (0.69) | GSK3BCA1CA2MAPK1CES1 | |
| SCHEMBL8398448 | 0.76 | KMT2A (0.52) | GSK3BCA2MAPK1CES1TDP1 | |
| SCHEMBL11713734 | 0.76 | GSK3B (0.69) | GSK3BCA1CA2MAPK1CES1 | |
| SCHEMBL1127783 | 0.76 | CES1 (0.56) | GSK3BCA1CA2MAPK1CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0068371-B1 | PROCESS FOR PREPARING SULFIDES | BASF Aktiengesellschaft (DE) | 1984-03-21 | — | — | EP | disclosed |
| US-4438282-A | REDUCTION OF SULFOXIDE WITH HYDRAZINE OR HYDROXYLAMINE OR DERIVATIVE | BASF AKTIENGESELLSCHAFT (DE) | 1984-03-20 | — | — | US | disclosed |
| EP-0068371-A1 | Process for preparing sulfides | BASF Aktiengesellschaft (DE) | 1983-01-05 | — | — | EP | disclosed |