Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 8/20 | 0.42 |
| ▸ | DRD4 | P21917 | 7/20 | 0.42 |
| ▸ | DRD3 | P35462 | 6/20 | 0.42 |
| ▸ | HTR7 | P34969 | 4/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.40 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8923621 | 0.83 | HTR3A (0.50) | ALDH1A1DRD2DRD4DRD3HTR1A | |
| SCHEMBL8921653 | 0.81 | HRH3 (0.52) | ALDH1A1DRD2HTR7HTR1AHTR2C | |
| SCHEMBL8630532 | 0.76 | DRD2 (0.46) | ALDH1A1MAPTDRD2DRD4DRD3 | |
| SCHEMBL8924034 | 0.74 | DRD3 (0.51) | ALDH1A1MAPTDRD2DRD4DRD3 | |
| SCHEMBL1388980 | 0.72 | DRD4 (0.48) | ALDH1A1MAPTDRD2DRD4DRD3 | |
| SCHEMBL6927518 | 0.67 | KDM4E (0.55) | ALDH1A1MAPTDRD2DRD4DRD3 | |
| SCHEMBL6125262 | 0.65 | KMT2A (0.58) | DRD2DRD4DRD3HTR7SIGMAR1 | |
| SCHEMBL8924222 | 0.65 | MAPT (0.47) | ALDH1A1MAPTDRD2DRD4DRD3 | |
| SCHEMBL27507443 | 0.64 | DRD2 (0.52) | ALDH1A1MAPTDRD2DRD4DRD3 | |
| SCHEMBL1447393 | 0.64 | CNR2 (0.55) | ALDH1A1DRD2DRD4DRD3HTR7 |
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-5686480-A | Fused tricyclic heteroaromatic derivatives as dopamine receptor subtype ligands | MERCK, SHARP & DOHME, LTD. (GB) | 1997-11-11 | — | — | US | claimed |
| US-5686480-A | Fused tricyclic heteroaromatic derivatives as dopamine receptor subtype ligands | MERCK, SHARP & DOHME, LTD. (GB) | 1997-11-11 | — | — | US | disclosed |