Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 10/20 | 0.52 |
| ▸ | NR3C2 | P08235 | 9/20 | 0.46 |
| ▸ | PGR | P06401 | 8/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | EED | O75530 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1492597 | 0.85 | NR3C1 (0.58) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL1493940 | 0.72 | NR3C1 (0.65) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL3688817 | 0.72 | NR3C1 (0.59) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL12505563 | 0.72 | NR3C1 (0.48) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL5520778 | 0.71 | NR3C1 (0.49) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL304124 | 0.71 | NR3C1 (0.64) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL303654 | 0.71 | NR3C1 (0.64) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL1493954 | 0.71 | NR3C1 (0.52) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL5521083 | 0.71 | NR3C1 (0.44) | NR3C1NR3C2PGRARPARP1 | |
| SCHEMBL6555672 | 0.70 | NR3C1 (0.48) | NR3C1NR3C2PGRARPARP1 |
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-1673088-A1 | 1,1,1- TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO¬2,3-C|PYRIDIN-2-YLMETHYL)PENTAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS GLUCOCORTICOID LIGANDS FOR THE TREATMENT OF INFLAMMATORY DISEASES AND DIABETES | BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005030213-A1 | 1,1,1-TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2005-04-07 | — | — | WO | disclosed |