Known targets — ChEMBL curated mechanism
ADORA1ADORA2AADORA2BADORA3GNRHRMPLPDE3APDE3BPDE4APDE4BPDE4CPDE4DPPARASLC5A2
The experimentally established mechanism targets of Isophthalic 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 | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | EDNRB | P24530 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Benzoic Acid SCHEMBL2196273 | 0.87 | CA2 (0.57) | KMT2AMEN1LMNACYP3A4SLC5A7 | |
| Terephthalic Acid SCHEMBL30148140 | 0.85 | MEN1 (0.48) | KMT2AMEN1LMNACYP3A4SLC5A7 | |
| Isophthalic Acid SCHEMBL11024437 | 0.83 | KMT2A (0.40) | KMT2AMEN1LMNACA2CA4 | |
| Isophthalic Acid SCHEMBL106621 | 0.82 | CA2 (0.52) | KMT2ACA2CA4HSD17B10GAA | |
| Beta-Naphtoic Acid SCHEMBL28561493 | 0.82 | CES2 (0.47) | KMT2AMEN1CYP3A4HSD17B10TDP1 | |
| Isophthalic Acid SCHEMBL11020627 | 0.81 | SMN1; SMN2 (0.38) | KMT2AMEN1LMNACA2CA4 | |
| Isophthalic Acid SCHEMBL28415654 | 0.81 | CA2 (0.56) | CA2CA4USP2TDP1ATM | |
| Isophthalic Acid SCHEMBL8435018 | 0.80 | DNM1 (0.47) | — | |
| Benzoic Acid SCHEMBL16106190 | 0.80 | CA2 (0.53) | KMT2AMEN1LMNACYP3A4SLC5A7 | |
| Cetrimonium SCHEMBL8437262 | 0.80 | DNM1 (0.47) | — |
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-11560579-B2 | Method for pretreating lignocellulosic biomass | Petróleo Brasileiro S.A.—Petrobras (BR) | 2023-01-24 | — | — | US | claimed |
| US-11560579-B2 | Method for pretreating lignocellulosic biomass | Petróleo Brasileiro S.A.—Petrobras (BR) | 2023-01-24 | — | — | US | disclosed |