Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PCNA | P12004 | 5/20 | 0.49 |
| ▸ | THRB | P10828 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | THRA | P10827 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.49 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30716576 | 0.85 | HPGD (0.68) | PCNATHRBLMNATHRAPOLB | |
| SCHEMBL8510463 | 0.85 | HPGD (0.68) | PCNATHRBLMNATHRAPOLB | |
| SCHEMBL1331519 | 0.82 | KDM4E (0.70) | LMNAPOLBHIF1AHPGDHSD17B10 | |
| SCHEMBL29503757 | 0.82 | KDM4E (0.70) | LMNAPOLBHIF1AHPGDHSD17B10 | |
| SCHEMBL26617181 | 0.82 | PCNA (0.49) | PCNATHRBLMNATHRAPOLB | |
| Hydrochloric Acid SCHEMBL28072109 | 0.81 | KDM4E (0.68) | LMNAPOLBHIF1AHPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL28072108 | 0.79 | KDM4E (0.66) | LMNAPOLBHIF1AHPGDHSD17B10 | |
| SCHEMBL19420576 | 0.79 | THRB (0.46) | PCNATHRBLMNATHRAPOLB | |
| SCHEMBL5928042 | 0.79 | THRB (0.53) | PCNATHRBLMNATHRAPOLB | |
| SCHEMBL29182113 | 0.78 | KLKB1 (0.67) | THRBLMNAPOLBHIF1AHPGD |
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-2013619-B1 | METHODS FOR USING HUMAN EMBRYONIC STEM CELLS TO EVALUATE TOXICITY OF PHARMACEUTICAL COMPOUNDS & OTHER CHEMICALS | WISCONSIN ALUMNI RES FOUND (US) | 2017-10-11 | — | — | EP | disclosed |
| US-4490221-A | Process for preparing iodothyronines and iodothyroacetic acids by electrochemical reduction at controlled potential | SPIRAL SOCIETE A RESPONSABILITE LIMITEE DITE (FR) | 1984-12-25 | — | — | US | disclosed |