Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 8/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | FABP5 | Q01469 | 6/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.32 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.31 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.31 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | PYGL | P06737 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1573844 | 0.95 | FFAR3 (0.40) | FFAR3ALDH1A1FABP4CYP1A2HTT | |
| SCHEMBL3704763 | 0.93 | FFAR3 (0.39) | FFAR3ALDH1A1FABP4CYP1A2HTT | |
| SCHEMBL3985967 | 0.90 | FFAR3 (0.43) | FFAR3ALDH1A1FABP4HTTFABP5 | |
| SCHEMBL14271660 | 0.83 | HTT (0.33) | FFAR3HTT | |
| SCHEMBL21547934 | 0.80 | KDM4E (0.52) | FFAR3CYP1A2 | |
| SCHEMBL9613266 | 0.79 | KDM4E (0.41) | ALDH1A1HTT | |
| SCHEMBL15166788 | 0.79 | PYGL (0.38) | FFAR3ALDH1A1HTTOPRM1OPRK1 | |
| SCHEMBL10153960 | 0.79 | FFAR3 (0.34) | FFAR3HTTOPRM1OPRK1OGFRL1 | |
| SCHEMBL10153975 | 0.79 | FFAR3 (0.34) | FFAR3HTTOPRM1OPRK1OGFRL1 | |
| SCHEMBL9595463 | 0.78 | ALDH1A1 (0.43) | ALDH1A1FABP4FABP5PYGL |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1727797-B1 | PROCESS FOR CROSS COUPLING INDOLES | BOEHRINGER INGELHEIM PHARMA (US) | 2012-05-30 | — | — | EP | disclosed |
| US-7408076-B2 | 2-Bromoanaline and 2-chloroaniline compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-08-05 | — | — | US | disclosed |
| US-7408076-B2 | 2-Bromoanaline and 2-chloroaniline compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-08-05 | — | — | US | disclosed |
| US-7332614-B2 | Process for cross coupling indoles | BOEHRINGER INGELHEIM INTERNATIONAL, GMBH (DE) | 2008-02-19 | — | — | US | disclosed |
| US-7332614-B2 | Process for cross coupling indoles | BOEHRINGER INGELHEIM INTERNATIONAL, GMBH (DE) | 2008-02-19 | — | — | US | disclosed |