Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 8/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15012294 | 0.87 | HTR2C (0.53) | HTR2CHPGDHRH3SMN1; SMN2NPC1 | |
| SCHEMBL31240238 | 0.86 | HTR2C (0.42) | HTR2CHPGDGRM2HRH3SMN1; SMN2 | |
| SCHEMBL17761016 | 0.84 | HPGD (0.46) | HTR2CHPGDHRH3RAB9A | |
| SCHEMBL28585580 | 0.80 | HPGD (0.48) | HTR2CHPGDHRH3NPC1RAB9A | |
| SCHEMBL3875051 | 0.75 | SMN1; SMN2 (0.56) | HPGDGRM2SMN1; SMN2RAB9A | |
| Hydrochloric Acid SCHEMBL5008548 | 0.75 | L3MBTL1 (0.54) | HRH3SMN1; SMN2NPC1RAB9A | |
| SCHEMBL31206570 | 0.74 | HTR2C (0.58) | HTR2CHPGDHRH3SMN1; SMN2NPC1 | |
| SCHEMBL2745784 | 0.73 | HTR2B (0.49) | HRH3NPC1RAB9A | |
| SCHEMBL26707398 | 0.73 | HPGD (0.61) | HTR2CHPGDHRH3SMN1; SMN2NPC1 | |
| SCHEMBL1118802 | 0.72 | HRH3 (0.61) | GRM2HRH3SMN1; SMN2CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107827841-A | Trifluoromethyl alcohol as Ror γ t conditioning agents | 詹森药业有限公司 | 2018-03-23 | — | — | CN | disclosed |
| CN-107108599-A | Trifluoromethanols as Ror gamma t modulators | 詹森药业有限公司 | 2017-08-29 | — | — | CN | disclosed |