Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3186387 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL4591420 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL3186377 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL3186370 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL3187185 | 0.90 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL13483390 | 0.90 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL3187179 | 0.90 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL3187169 | 0.90 | ALDH1A1 (0.46) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 | |
| SCHEMBL3200136 | 0.88 | MEN1 (0.42) | ALDH1A1TSHRMEN1KMT2AALOX15 | |
| SCHEMBL3191564 | 0.88 | ALDH1A1 (0.57) | ALDH1A1TSHRCYP3A4CYP2C19NPSR1 |
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-1379249-A4 | FUSED CYCLIC SUCCINIMIDE COMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION | BRISTOL MYERS SQUIBB CO (US) | 2008-01-09 | — | — | EP | claimed |
| EP-1379249-A1 | FUSED CYCLIC SUCCINIMIDE COMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION | Bristol-Myers Squibb Company (US) | 2004-01-14 | — | — | EP | claimed |
| WO-2002067939-A1 | FUSED CYCLIC SUCCINIMIDE COMPOUNDS AND ANALOGS THEREOF, MODULATORS OF NUCLEAR HORMONE RECEPTOR FUNCTION | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-09-06 | — | — | WO | claimed |