Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.39 |
| ▸ | PSAT1 | Q9Y617 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL787443 | 0.85 | — | — | |
| SCHEMBL1005385 | 0.78 | ALDH1A1 (0.45) | TAAR1CYP3A4HSD17B10TDP1ALDH1A1 | |
| SCHEMBL5747628 | 0.76 | CA1 (0.47) | TAAR1CYP3A4HSD17B10TDP1ALDH1A1 | |
| SCHEMBL8712652 | 0.74 | MAOB (0.48) | TAAR1CYP3A4HSD17B10TDP1ALDH1A1 | |
| SCHEMBL28054773 | 0.74 | ALDH1A1 (0.41) | TAAR1CYP3A4HSD17B10TDP1ALDH1A1 | |
| SCHEMBL8674538 | 0.74 | TAAR1 (0.48) | TAAR1CYP3A4HSD17B10TDP1ALDH1A1 | |
| Biphenyl SCHEMBL27896790 | 0.74 | AOC3 (0.54) | TAAR1CHRNB2CHRNA4CYP3A4HSD17B10 | |
| Glycine SCHEMBL8217220 | 0.73 | TP53 (0.48) | TAAR1ALDH1A1TP53SRRPSAT1 | |
| Biphenyl SCHEMBL21932883 | 0.73 | ALDH1A1 (0.69) | TAAR1CHRNB2CHRNA4CYP3A4HSD17B10 | |
| SCHEMBL10969109 | 0.72 | ALDH1A1 (0.68) | HSD17B10ALDH1A1TP53CA1MGLL |
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-2021116617-A1 | PROCESS FOR INDUSTRIAL PREPARATION OF THE DISODIUM SALT OF ((2S)-3-([1,1'-BIPHENYL]-4-YL)-2-((HYDROXY((1R)-1-(((1-(ISOBUTYRYLOXY)ETHOXY)CARBONYL)AMINO)ETHYL)PHOSPHORYL)METHYL)PROPANOYL)-L-ALANINE | PHARMALEADS (FR) | 2021-06-17 | — | — | WO | disclosed |