Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTRC | Q99895 | 1/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.40 |
| ▸ | RARB | P10826 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | EIF4A1 | P60842 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | 0.88 | RARB (0.41) | AKR1C2AKR1C1RARBALDH1A1S1PR1 | |
| SCHEMBL9800787 | 0.87 | RARB (0.40) | AKR1C2AKR1C1PTGDR2RARBALDH1A1 | |
| SCHEMBL9800791 | 0.86 | FFAR4 (0.49) | RARBABL1EIF4A1FAAHMGLL | |
| SCHEMBL9800808 | 0.84 | TSHR (0.45) | AKR1C2AKR1C1PTGDR2RARB | |
| SCHEMBL9800817 | 0.84 | RARB (0.45) | RARBMEN1KMT2AALDH1A1S1PR1 | |
| SCHEMBL13198355 | 0.80 | AKR1C2 (0.47) | AKR1C2AKR1C1RARBMEN1KMT2A | |
| SCHEMBL9800824 | 0.79 | FFAR4 (0.51) | MEN1KMT2AALDH1A1ABL1RAB9A | |
| SCHEMBL9800825 | 0.78 | FFAR4 (0.43) | KMT2AALDH1A1NPC1RAB9A | |
| SCHEMBL9800831 | 0.77 | KDM1A (0.47) | PTGDR2MEN1KMT2AABL1 | |
| SCHEMBL9800819 | 0.77 | MGLL (0.40) | RARBMEN1KMT2AALDH1A1FAAH |
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 |