Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.54 |
| ▸ | DRD3 | P35462 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 5/20 | 0.52 |
| ▸ | GFER | P55789 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8635355 | 0.91 | GAA (0.55) | GAAHTR1AHTR2ADRD3SMN1; SMN2 | |
| SCHEMBL8637476 | 0.75 | SMN1; SMN2 (0.56) | GAAHTR1AHTR2ADRD3SMN1; SMN2 | |
| SCHEMBL8635011 | 0.73 | ITGB3 (0.48) | GAASMN1; SMN2ALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL8837973 | 0.72 | ITGB3 (0.47) | GAAALDH1A1TSHR | |
| SCHEMBL1769571 | 0.71 | MEN1 (0.62) | SMN1; SMN2ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL4418666 | 0.71 | KMT2A (0.66) | SMN1; SMN2ALDH1A1MEN1KMT2ATP53 | |
| SCHEMBL1769568 | 0.71 | MEN1 (0.62) | SMN1; SMN2ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL4527831 | 0.70 | DRD3 (1.00) | HTR1AHTR2ADRD3SMN1; SMN2 | |
| SCHEMBL26604260 | 0.70 | KMT2A (0.61) | GAASMN1; SMN2ALDH1A1MEN1KMT2A | |
| SCHEMBL26604262 | 0.70 | KMT2A (0.61) | GAASMN1; SMN2ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |