Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 4/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.33 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10694109 | 0.85 | POLB (0.35) | ALDH1A1POLBHSD17B10DRD2HTT | |
| SCHEMBL10693548 | 0.84 | RAD52 (0.35) | ALDH1A1POLBHSD17B10DRD2HTT | |
| SCHEMBL10696619 | 0.83 | RAD52 (0.34) | ALDH1A1POLBHSD17B10DRD2HTT | |
| SCHEMBL10694576 | 0.82 | POLB (0.33) | ALDH1A1POLBHSD17B10DRD2HTT | |
| SCHEMBL10689170 | 0.81 | ADRA1A (0.40) | ALDH1A1DRD2HTTMAPTADRA1D | |
| SCHEMBL10692777 | 0.81 | OPRL1 (0.35) | ALDH1A1POLBHSD17B10DRD2MAPT | |
| SCHEMBL10694665 | 0.81 | RAD52 (0.36) | ALDH1A1POLBHSD17B10DRD2HTT | |
| SCHEMBL10691826 | 0.78 | HTR2A (0.43) | ALDH1A1POLBDRD2HTTL3MBTL1 | |
| Hydrochloric Acid SCHEMBL10695977 | 0.76 | DRD2 (0.42) | ALDH1A1DRD2ADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL10693968 | 0.76 | SMPD1 (0.52) | DRD2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4778793-A | CONTROLLING CALCIUM CONCENTRATION-CARDIOVASCULAR DISORDERS | HOECHST AKTIENGESELLSCHAFT (DE) | 1988-10-18 | — | — | US | disclosed |
| EP-0212216-A1 | Dihydroquinolinone derivatives, processes for their preparation, medicaments containing them, the use of these medicaments, and intermediates for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-03-04 | — | — | EP | disclosed |