Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 5/20 | 0.40 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.39 |
| ▸ | OXTR | P30559 | 2/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 2/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.37 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.37 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10415568 | 0.89 | RARB (0.41) | RARBAKR1C2AKR1C1MGLLTHRA | |
| SCHEMBL9800791 | 0.87 | FFAR4 (0.49) | RARBMGLLFFAR4FAAH | |
| SCHEMBL9800804 | 0.87 | CTRC (0.44) | RARBPTGDR2AKR1C2AKR1C1MGLL | |
| SCHEMBL9800808 | 0.85 | TSHR (0.45) | RARBPTGDR2AKR1C2AKR1C1THRA | |
| SCHEMBL9800817 | 0.85 | RARB (0.45) | RARBTHRATHRBS1PR1S1PR3 | |
| SCHEMBL9800824 | 0.80 | FFAR4 (0.51) | RAB9AALDH1A1FFAR4 | |
| SCHEMBL9800825 | 0.79 | FFAR4 (0.43) | THRBNPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL11405553 | 0.79 | SPHK1 (0.39) | NPC1RAB9AALDH1A1HPGD | |
| SCHEMBL12370830 | 0.79 | F2 (0.51) | RARBTHRATHRBTP53SMN1; SMN2 | |
| SCHEMBL9800831 | 0.78 | KDM1A (0.47) | PTGDR2HSD17B10 |
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-0249081-B1 | TRANSHEXAHYDROTEREPHTALIC ACID ESTER DERIVATIVES | Sato, Hisato (JP) | 1991-03-13 | — | — | EP | disclosed |
| US-4946991-A | Liquid ccrystals or their additives | SATO HISATO (JP) | 1990-08-07 | — | — | US | disclosed |