Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL805159 | 0.83 | HSD17B10 (0.65) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL17450485 | 0.82 | HSD17B10 (0.47) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL21397 | 0.76 | HSD17B10 (0.49) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL14579650 | 0.75 | HSD17B10 (0.47) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL16622152 | 0.75 | HSD17B10 (0.56) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL17072158 | 0.74 | CA2 (0.44) | TAAR1 | |
| SCHEMBL22220774 | 0.74 | HCRTR1 (0.49) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL487942 | 0.73 | HSD17B10 (0.62) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL10526058 | 0.73 | IDO1 (0.61) | HSD17B10IDO1TAAR1ADRA1AHTR2A | |
| SCHEMBL326803 | 0.73 | NQO1 (0.52) | HSD17B10MTNR1AMTNR1B |
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-1149069-A1 | PHENYLGLYCINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-10-31 | — | — | EP | disclosed |
| WO-2000035858-A1 | PHENYLGLYCINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-06-22 | — | — | WO | disclosed |