Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31589200 | 1.00 | CYP4F2 (0.42) | CYP4F2CYP4A11FFAR4ALKBH1NQO2 | |
| SCHEMBL1162423 | 0.86 | ALDH1A1 (0.52) | ALDH1A1TSHRCYP1A1CYP1B1CYP19A1 | |
| SCHEMBL28597517 | 0.84 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP1A1CYP1B1CYP19A1 | |
| SCHEMBL4748779 | 0.83 | ALDH1A1 (0.53) | CYP4F2CYP4A11FFAR4NQO2ALDH1A1 | |
| SCHEMBL7664052 | 0.80 | CYP4F2 (0.44) | CYP4F2CYP4A11FFAR4ALKBH1NQO2 | |
| SCHEMBL319124 | 0.79 | IDO1 (0.42) | CYP4F2CYP4A11 | |
| SCHEMBL17386216 | 0.78 | TACR1 (0.42) | FFAR4ALDH1A1MAOBTSHRCYP1A1 | |
| SCHEMBL241171 | 0.78 | PTGS2 (0.43) | CYP4F2CYP4A11FFAR4ALKBH1NQO2 | |
| Hydrochloric Acid SCHEMBL7542459 | 0.78 | GRIN2D (0.39) | CYP4F2CYP4A11FFAR4ALKBH1NQO2 | |
| SCHEMBL28986266 | 0.77 | ALDH1A1 (0.37) | ALDH1A1MAOBTSHRCYP1A1CYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015162538-A1 | HETEROCYCLIC COMPOUNDS AS CALCIUM SENSING RECEPTOR MODULATORS FOR THE TREATMENT OF HYPERPARATHYROIDISM, CHRONIC RENAL FAILURE AND CHRONIC KIDNEY DISEASE | LUPIN LIMITED (IN) | 2015-10-29 | — | — | WO | disclosed |
| EP-2254885-A1 | (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES | AiCuris GmbH & Co. KG (DE) | 2010-12-01 | — | — | EP | disclosed |
| WO-2009115213-A1 | (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES | AICURIS GMBH & CO. KG (DE) | 2009-09-24 | — | — | WO | disclosed |