Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.51 |
| ▸ | CA2 | P00918 | 5/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | TAS2R14 | Q9NYV8 | 3/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6063666 | 1.00 | CA1 (0.51) | CA1CA2HPGDLMNAALDH1A1 | |
| SCHEMBL7373529 | 0.89 | CA1 (0.49) | CA1CA2HPGDLMNAALDH1A1 | |
| SCHEMBL9638788 | 0.89 | CA1 (0.49) | CA1CA2HPGDLMNAALDH1A1 | |
| SCHEMBL6901107 | 0.88 | CA1 (0.53) | CA1CA2HPGDLMNAALDH1A1 | |
| SCHEMBL5839287 | 0.87 | TSHR (0.49) | CA1CA2HPGDLMNAALDH1A1 | |
| SCHEMBL5839277 | 0.87 | TSHR (0.49) | CA1CA2HPGDLMNAALDH1A1 | |
| SCHEMBL1414135 | 0.84 | TSHR (0.52) | HPGDLMNAALDH1A1PKMKMT2A | |
| SCHEMBL2404318 | 0.84 | TSHR (0.52) | HPGDLMNAALDH1A1PKMKMT2A | |
| SCHEMBL1414137 | 0.84 | TSHR (0.52) | HPGDLMNAALDH1A1PKMKMT2A | |
| Hydrochloric Acid SCHEMBL1972876 | 0.83 | TSHR (0.51) | HPGDLMNAALDH1A1PKMKMT2A |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5618970-A | Hydrogenation | PFIZER INC. (US) | 1997-04-08 | — | — | US | disclosed |
| EP-0644176-B1 | Hydrogenation | PFIZER LTD (GB) | 1995-11-15 | — | — | EP | disclosed |
| WO-1995008526-A1 | HYDROGENATION | PFIZER RESEARCH AND DEVELOPMENT COMPANY, N.V./S.A. (IE) | 1995-03-30 | — | — | WO | disclosed |
| EP-0644176-A1 | Hydrogenation | Pfizer Limited (GB) | 1995-03-22 | — | — | EP | disclosed |
| US-5192800-A | Hypotensive agents | PFIZER INC. (US) | 1993-03-09 | — | — | US | disclosed |
| EP-0342850-B1 | ENANTIOMERIC GLUTARAMIDE DIURETIC AGENTS | Pfizer Limited (GB) | 1992-05-20 | — | — | EP | disclosed |
| EP-0274234-B1 | SPIRO-SUBSITUTED GLUTARAMIDE DIURETIC AGENTS | Pfizer Limited (GB) | 1991-09-11 | — | — | EP | disclosed |
| US-5030654-A | Glutaramide diuretic agents | PFIZER INC. (US) | 1991-07-09 | — | — | US | disclosed |
| EP-0342850-A1 | Enantiomeric glutaramide diuretic agents | Pfizer Limited (GB) | 1989-11-23 | — | — | EP | disclosed |
| EP-0274234-A2 | Spiro-subsituted glutaramide diuretic agents | Pfizer Limited (GB) | 1988-07-13 | — | — | EP | disclosed |