Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Phenylpropanolamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A known ✓ | P35348 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.80 |
| ▸ | LMNA | P02545 | 4/20 | 0.80 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.80 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.80 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.77 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.52 |
| ▸ | MIF | P14174 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.47 |
| ▸ | THPO | P40225 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | RGS12 | O14924 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| (1S,2R)-Phenylpropanolamine SCHEMBL17294109 | 1.00 | KDM4E (0.80) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Phenylpropanolamine SCHEMBL1171525 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Cathine SCHEMBL34132 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Phenylpropanolamine SCHEMBL11113727 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| (1R,2S)-Phenylpropanolamine SCHEMBL152038 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Phenylpropanolamine SCHEMBL12022735 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Phenylpropanolamine SCHEMBL125333 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Phenylpropanolamine SCHEMBL98590 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| (1S,2R)-Phenylpropanolamine SCHEMBL26905 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A | |
| Phenylpropanolamine SCHEMBL98589 | 0.89 | KDM4E (1.00) | KDM4ELMNAHIF1AADRA2CADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3149024-A1 | DERIVATIVES OF DOLAPROINE-DOLAISOLEUINE PEPTIDES | Agensys, Inc. (US) | 2017-04-05 | — | — | EP | disclosed |
| WO-2015183978-A1 | DERIVATIVES OF DOLAPROINE-DOLAISOLEUINE PEPTIDES | AGENSYS, INC. (US) | 2015-12-03 | — | — | WO | disclosed |