Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Adipic 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 | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.70 |
| ▸ | CA1 | P00915 | 1/20 | 0.70 |
| ▸ | CA2 | P00918 | 1/20 | 0.70 |
| ▸ | CA3 | P07451 | 1/20 | 0.70 |
| ▸ | TYR | P14679 | 1/20 | 0.70 |
| ▸ | DRD1 | P21728 | 1/20 | 0.70 |
| ▸ | CA4 | P22748 | 1/20 | 0.70 |
| ▸ | CA6 | P23280 | 1/20 | 0.70 |
| ▸ | CA5A | P35218 | 1/20 | 0.70 |
| ▸ | CA7 | P43166 | 1/20 | 0.70 |
| ▸ | CA9 | Q16790 | 1/20 | 0.70 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.70 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.70 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | HSD17B3 | P37058 | 7/20 | 0.50 |
| ▸ | DPP4 | P27487 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Sebacic Acid SCHEMBL11829854 | 0.98 | CA12 (0.67) | CA12CA1CA2CA3TYR | |
| Paraben SCHEMBL9835893 | 0.91 | CA2 (0.76) | CA12CA1CA2CA3TYR | |
| Terephthalic Acid SCHEMBL10927542 | 0.91 | TSHR (0.63) | CA12CA1CA2CA3TYR | |
| Terephthalic Acid SCHEMBL9859986 | 0.91 | TSHR (0.63) | CA12CA1CA2CA3TYR | |
| Terephthalic Acid SCHEMBL17727985 | 0.91 | TSHR (0.63) | CA12CA1CA2CA3TYR | |
| Terephthalic Acid SCHEMBL9739994 | 0.91 | TSHR (0.63) | CA12CA1CA2CA3TYR | |
| Terephthalic Acid SCHEMBL352170 | 0.91 | TSHR (0.63) | CA12CA1CA2CA3TYR | |
| Paraben SCHEMBL27754690 | 0.91 | HSD17B3 (0.66) | CA12CA1CA2CA3TYR | |
| Decanoic Acid SCHEMBL28853577 | 0.89 | HSD17B3 (0.67) | TSHRHSD17B3HDAC11ALDH1A1TDP1 | |
| Myristic Acid SCHEMBL1615180 | 0.89 | HSD17B3 (0.67) | TSHRHSD17B3HDAC11ALDH1A1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104169365-B | Aromatic copolycarbonate system composite resin composition and products formed | 三菱工程塑胶株式会社 | 2016-08-24 | — | — | CN | disclosed |
| WO-2004064762-A9 | NOVEL COCRYSTALLIZATION | S S C I INC (US) | 2006-07-27 | — | — | WO | disclosed |