Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | AGXT | P21549 | 2/20 | 0.50 |
| ▸ | DAO | P14920 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 10/20 | 0.44 |
| ▸ | HTR2C | P28335 | 10/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.40 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1121847 | 1.00 | IDO1 (0.50) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL29447941 | 1.00 | IDO1 (0.50) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL29886684 | 0.87 | IDO1 (0.47) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL81791 | 0.87 | IDO1 (0.47) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL7700904 | 0.85 | IDO1 (0.58) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL17858489 | 0.85 | IDO1 (0.46) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL5038446 | 0.84 | IDO1 (0.52) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL18007006 | 0.84 | IDO1 (0.44) | IDO1AGXTDAOKDM4ESMN1; SMN2 | |
| SCHEMBL7769791 | 0.84 | MAOB (0.41) | IDO1AGXTDAOHTR2AHTR2C | |
| SCHEMBL27830893 | 0.82 | DPP4 (0.43) | IDO1AGXTHTR2AALDH1A1 |
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-1599201-B1 | SELECTIVE NON-STEROIDAL GLUCOCORTICOID RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2010-04-14 | — | — | EP | disclosed |
| WO-2004075840-A9 | SELECTIVE NON-STEROIDAL GLUCOCORTICOID RECEPTOR MODULATORS | MERCK & CO INC (US) | 2005-08-04 | — | — | WO | disclosed |