Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 2/20 | 0.55 |
| ▸ | DHPS | P49366 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 4/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.42 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 1/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.41 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 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 | |
|---|---|---|---|---|
| SCHEMBL1915438 | 0.82 | AXL (0.53) | AXLDHPSIDO1NOS1JAK2 | |
| SCHEMBL2627058 | 0.79 | AXL (0.68) | AXLDHPSIDO1NOS1JAK2 | |
| SCHEMBL10285272 | 0.74 | AXL (0.62) | AXLDHPSIDO1NOS1JAK2 | |
| SCHEMBL1134888 | 0.72 | CSF1R (0.56) | AXLIDO1NOS1JAK2JAK1 | |
| SCHEMBL29360810 | 0.72 | CSF1R (0.56) | AXLIDO1NOS1JAK2JAK1 | |
| SCHEMBL12683720 | 0.72 | AXL (1.00) | AXLIDO1NOS1JAK2JAK1 | |
| SCHEMBL31602273 | 0.70 | KMT2A (0.50) | CYP2C19 | |
| SCHEMBL31602274 | 0.70 | KMT2A (0.50) | CYP2C19 | |
| Acetic Acid SCHEMBL27653221 | 0.70 | IDO1 (0.49) | AXLDHPSIDO1NOS1JAK2 | |
| SCHEMBL1853888 | 0.69 | NPC1 (0.62) | DHPSJAK2JAK1TRPV1NPC1 |
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-1542996-A2 | OCTAHYDRO-2-H-NAPHTHO 1,2-F INDOLE-4-CARBOXAMIDE DERIVATIVES AS SELECTIVE GLUCOCORTICOID RECEPTOR MODULATORS | Merck & Co., Inc. (US) | 2005-06-22 | — | — | EP | disclosed |
| WO-2004026248-A2 | OCTAHYDRO-2-H-NAPHTHO[1,2-F] INDOLE-4-CARBOXAMIDE DERIVATIVES AS SELECTIVE GLUCOCORTICOID RECEPTOR MODULATORS | MERCK & CO., INC. (US) | 2004-04-01 | — | — | WO | disclosed |