Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | SI | P14410 | 1/20 | 0.32 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL1879598 | 0.76 | KMT2A (0.46) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL23849033 | 0.69 | KMT2A (0.43) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL10728761 | 0.69 | KMT2A (0.40) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL27163257 | 0.67 | L3MBTL1 (0.46) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL13199996 | 0.67 | L3MBTL1 (0.42) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL18869319 | 0.67 | TSHR (0.49) | KMT2ATSHRPOLBCYP1A2ALDH1A1 | |
| SCHEMBL12306313 | 0.66 | KMT2A (0.55) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL356135 | 0.66 | — | — | |
| SCHEMBL28585576 | 0.66 | L3MBTL1 (0.52) | KMT2AL3MBTL1TSHRPOLBCYP1A2 | |
| SCHEMBL515049 | 0.65 | ALDH1A1 (0.63) | TSHRCYP1A2ALDH1A1CYP3A4ALOX15 |
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-4643994-A | ANTICOAGULANTS, ANTIBIOTICS | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1987-02-17 | — | — | US | disclosed |
| EP-0185324-A2 | Novel organic trithio oxides and method for the preparation thereof | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) | 1986-06-25 | — | — | EP | disclosed |