Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.42 |
| ▸ | DHFR | P00374 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | C1S | P09871 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL4068350 | 0.89 | ADRB1 (0.53) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL4073004 | 0.89 | ADRB1 (0.65) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL8263647 | 0.85 | ADRB1 (0.56) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL28035473 | 0.80 | MAPT (0.44) | ADRB1MAPTALDH1A1NOTUMHSP90AA1 | |
| SCHEMBL9715330 | 0.80 | ADRB1 (0.62) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL11103700 | 0.80 | ADRB1 (0.74) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL10373770 | 0.80 | ADRB1 (0.74) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL6399910 | 0.79 | ADRA2C (0.55) | MAPTALDH1A1CA12CA1CA2 | |
| SCHEMBL4067230 | 0.79 | ADRB1 (0.58) | ADRB1KCNH2MAPTALDH1A1RAB9A | |
| SCHEMBL4067588 | 0.78 | HTR3E (0.56) | ADRB1KCNH2MAPTALDH1A1HTR7 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1054887-A1 | BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | Amgen Inc. (US) | 2000-11-29 | — | — | EP | claimed |
| WO-1999040091-A1 | BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | AMGEN INC. (US) | 1999-08-12 | — | — | WO | claimed |
| EP-1415986-B1 | SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | BANYU PHARMA CO LTD (JP) | 2009-04-08 | — | — | EP | disclosed |
| US-7205417-B2 | Spiro compounds | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2007-04-17 | — | — | US | disclosed |