Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.52 |
| ▸ | DRD2 | P14416 | 3/20 | 0.49 |
| ▸ | DRD3 | P35462 | 3/20 | 0.49 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | PHGDH | O43175 | 2/20 | 0.45 |
| ▸ | GNRHR | P30968 | 1/20 | 0.45 |
| ▸ | ACKR3 | P25106 | 5/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7109637 | 0.89 | HTR1A (0.52) | HTR1ADRD2DRD3DRD4HTR2A | |
| SCHEMBL7184572 | 0.80 | ALDH1A1 (0.62) | HTR1ADRD2DRD3OPRM1MEN1 | |
| SCHEMBL18998015 | 0.79 | KDM4E (0.63) | MEN1KMT2AALDH1A1HSD17B10PHGDH | |
| SCHEMBL7183141 | 0.79 | ALDH1A1 (0.57) | HTR1ADRD2DRD3DRD4OPRM1 | |
| SCHEMBL6858059 | 0.79 | KDM4E (0.59) | HTR1ADRD2DRD3DRD4OPRM1 | |
| SCHEMBL6863207 | 0.79 | DRD2 (0.54) | HTR1ADRD2DRD3DRD4OPRM1 | |
| SCHEMBL6858056 | 0.78 | ALDH1A1 (0.54) | MEN1KMT2AALDH1A1SMN1; SMN2FAAH | |
| SCHEMBL27040179 | 0.77 | HTR7 (0.62) | DRD4MEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL10145077 | 0.76 | ALDH1A1 (0.60) | MEN1KMT2AALDH1A1SMN1; SMN2HSD17B10 | |
| SCHEMBL31721209 | 0.76 | ALDH1A1 (0.60) | MEN1KMT2AALDH1A1SMN1; SMN2HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998020349-A1 | COMPLEX CHEMICAL LIBRARIES | ISIS PHARMACEUTICALS, INC. (US) | 1998-05-14 | — | — | WO | disclosed |