Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4273424 | 0.72 | LTA4H (0.39) | TDP1LMNAMAPTKDM4ECYP1A2 | |
| SCHEMBL28665887 | 0.70 | LTA4H (0.38) | TDP1LMNAMAPTKDM4ECYP1A2 | |
| SCHEMBL23496618 | 0.69 | EPHX1 (0.34) | ALDH1A1LMNAMAPTTSHRHPGD | |
| SCHEMBL3088326 | 0.68 | EPHX1 (0.37) | ALDH1A1TDP1LMNATSHRTP53 | |
| SCHEMBL17011668 | 0.67 | KMT2A (0.40) | ALDH1A1TDP1LMNARECQLMAPT | |
| SCHEMBL5702430 | 0.66 | EPHX1 (0.35) | LMNATSHRHPGD | |
| SCHEMBL29090858 | 0.66 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1LMNA | |
| SCHEMBL3161563 | 0.66 | ALOX15 (0.48) | ALDH1A1TDP1MAPTCYP2C9GAA | |
| SCHEMBL29494687 | 0.66 | ALOX15 (0.48) | ALDH1A1TDP1MAPTCYP2C9GAA | |
| SCHEMBL863708 | 0.65 | ALDH1A1 (0.62) | ALDH1A1TDP1ADRA2BPTGS1LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0299424-B1 | Thiosulfinic-acid derivatives, and the use of thiosulfin-acid derivatives for the manufacture of a medicament for the treatment of inflammatory diseases | BOEHRINGER MANNHEIM GMBH (DE) | 1993-10-20 | — | — | EP | disclosed |
| EP-0299424-A2 | Thiosulfinic-acid derivatives, and the use of thiosulfin-acid derivatives for the manufacture of a medicament for the treatment of inflammatory diseases | Roche Diagnostics GmbH (DE) | 1989-01-18 | — | — | EP | disclosed |