Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.56 |
| ▸ | HTR3A | P46098 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | APEX1 | P27695 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 5/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9779274 | 0.80 | GABBR2 (0.61) | TSHRNFKB1LMNACYP2C9CYP1A2 | |
| SCHEMBL28331437 | 0.80 | TAAR1 (0.54) | TAAR1TSHRNFKB1HTR3AHIF1A | |
| SCHEMBL5230376 | 0.80 | GABBR2 (0.59) | TSHRNFKB1LMNACYP2C9CYP1A2 | |
| SCHEMBL7396004 | 0.80 | GABBR2 (0.61) | TSHRNFKB1LMNACYP2C9CYP1A2 | |
| SCHEMBL9787802 | 0.79 | GABBR2 (0.61) | TAAR1CYP1A2CYP2D6SLC6A2SLC6A3 | |
| SCHEMBL1986953 | 0.79 | GABBR2 (0.61) | TAAR1CYP1A2CYP2D6SLC6A2SLC6A3 | |
| SCHEMBL4789777 | 0.79 | GABBR2 (0.61) | TAAR1CYP1A2CYP2D6SLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL14764043 | 0.77 | GABBR2 (0.59) | TAAR1CYP1A2CYP2D6SLC6A2SLC6A3 | |
| SCHEMBL24511029 | 0.77 | ESR1 (0.65) | TAAR1TSHRNFKB1HTR3AHIF1A | |
| SCHEMBL5553015 | 0.77 | TDP1 (0.60) | TAAR1TSHRNFKB1HIF1AALOX15 |
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-4401830-A | Process for preparation of 3-alkoxy-4-hydroxyphenylacetic acid | UBE INDUSTRIES, LTD. (JP) | 1983-08-30 | — | — | US | disclosed |
| US-4329497-A | Method for the production of 4-hydroxyphenylacetic acid | DIAMALT AKTIENGESELLSCHAFT (DE) | 1982-05-11 | — | — | US | disclosed |