Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 3/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.36 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.36 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.36 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.36 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | CETP | P11597 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20197127 | 0.87 | PDPK1 (0.50) | TSHRCYP3A4ALDH1A1BCHEACHE | |
| SCHEMBL20197126 | 0.87 | PDPK1 (0.50) | TSHRCYP3A4ALDH1A1BCHEACHE | |
| SCHEMBL20197348 | 0.87 | PDPK1 (0.50) | TSHRCYP3A4ALDH1A1BCHEACHE | |
| SCHEMBL8500194 | 0.87 | TSHR (0.57) | L3MBTL1TSHRTDP1CYP3A4ALDH1A1 | |
| SCHEMBL9456326 | 0.87 | PDPK1 (0.50) | TSHRCYP3A4ALDH1A1BCHEACHE | |
| SCHEMBL9456323 | 0.87 | PDPK1 (0.50) | TSHRCYP3A4ALDH1A1BCHEACHE | |
| SCHEMBL13996383 | 0.87 | PDPK1 (0.50) | TSHRCYP3A4ALDH1A1BCHEACHE | |
| SCHEMBL7438014 | 0.82 | LTA4H (0.49) | L3MBTL1TSHRTDP1CYP3A4ALDH1A1 | |
| SCHEMBL7426068 | 0.82 | LTA4H (0.49) | L3MBTL1TSHRTDP1CYP3A4ALDH1A1 | |
| SCHEMBL14000857 | 0.82 | GBA1 (0.41) | TSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5977078-A | CELL PERMEABLE ANTAGONIST | THE REGENTS OF THE UNIVESITY OF CALIFORNIA (US) | 1999-11-02 | — | — | US | disclosed |
| US-5880099-A | ALTERING CHLORIDE ION SECRETION ACROSS CELL MEMBRANE BY CONTACTING CELL WITH CELL PERMEABLE AGONIST OR ANTAGONIST OF INOSITOL POLYPHOSPHATES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1999-03-09 | — | — | US | disclosed |