Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Propionic Acid. 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 | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.51 |
| ▸ | ADRA2A known ✓ | P08913 | 3/20 | 0.45 |
| ▸ | ADRA2C known ✓ | P18825 | 3/20 | 0.45 |
| ▸ | ADRA1A known ✓ | P35348 | 3/20 | 0.45 |
| ▸ | ADRA2B known ✓ | P18089 | 2/20 | 0.45 |
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.41 |
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL11276785 | 0.89 | TMEM97 (0.63) | TMEM97SIGMAR1MAPTCYP1A2TP53 | |
| Propionic Acid SCHEMBL11272923 | 0.84 | HCAR2 (0.47) | CYP1A2HIF1AHCAR2 | |
| Bromide SCHEMBL11269859 | 0.77 | SIGMAR1 (0.42) | TMEM97SIGMAR1MAPTCYP1A2TP53 | |
| Bromide SCHEMBL11275657 | 0.77 | HCAR2 (0.43) | SIGMAR1MAPTCYP1A2TSHRNFKB1 | |
| Acetic Acid SCHEMBL11275107 | 0.77 | MAPT (0.61) | TMEM97SIGMAR1MAPTCYP1A2TP53 | |
| Bromide SCHEMBL11267343 | 0.76 | ACHE (0.48) | MAPTCYP1A2TP53ALOX15TSHR | |
| SCHEMBL3720173 | 0.76 | KDM4E (0.70) | MAPTCYP1A2HIF1AHSD17B10KDM4E | |
| SCHEMBL151952 | 0.75 | HCAR2 (0.57) | CYP1A2HCAR2 | |
| SCHEMBL29921611 | 0.75 | HCAR2 (0.57) | CYP1A2HCAR2 | |
| SCHEMBL14756847 | 0.75 | MAPT (0.70) | TMEM97SIGMAR1MAPTCYP1A2TP53 |
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-4327022-A | Heterocyclic alkyl naphthols | STERLING DRUG INC. (US) | 1982-04-27 | — | — | US | disclosed |
| US-4169108-A | 5(OR 6)-[(Substituted-amino)alkyl]-2,3-naphthalenediols | STERLING DRUG INC. (US) | 1979-09-25 | — | — | US | disclosed |