Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.69 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | GPR84 | Q9NQS5 | 8/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.43 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7704238 | 0.96 | CA2 (0.75) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL27218453 | 0.96 | CA2 (0.69) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL29053765 | 0.96 | CA2 (0.75) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL5012736 | 0.96 | CA2 (0.75) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL11307626 | 0.96 | CA2 (0.69) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL29176448 | 0.96 | CA2 (0.75) | CA2CA1GPR84NFKB1CYP3A4 | |
| Zinc Ion SCHEMBL8623779 | 0.96 | CA2 (0.69) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL9158148 | 0.96 | CA2 (0.75) | CA2CA1GPR84NFKB1CYP3A4 | |
| Lithium Ion SCHEMBL11432144 | 0.96 | CA2 (0.69) | CA2CA1GPR84NFKB1CYP3A4 | |
| SCHEMBL5690631 | 0.96 | CA2 (0.75) | CA2CA1GPR84NFKB1CYP3A4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5271855-A | Use of metal soaps of polycarboxylic acids or polycarboxylic acid partial esters as processing aids for polyesters | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1993-12-21 | — | — | US | disclosed |
| EP-0527165-A1 | USE OF METAL SOAPS OF POLYCARBOXYLIC ACIDS OR POLYCARBOXYLIC ACID PARTIAL ESTERS AS PROCESSING AIDS FOR POLYESTERS | Henkel Kommanditgesellschaft auf Aktien (DE) | 1993-02-17 | — | — | EP | disclosed |
| WO-1991017208-A1 | USE OF METAL SOAPS OF POLYCARBOXYLIC ACIDS OR POLYCARBOXYLIC ACID PARTIAL ESTERS AS PROCESSING AIDS FOR POLYESTERS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1991-11-14 | — | — | WO | disclosed |
| US-3953616-A | POTATOES, 1A-2A SALTS OF MONOALKYL FUMARATES AND MALEATES | PFIZER INC. (US) | 1976-04-27 | — | — | US | disclosed |