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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.44 |
| ▸ | TTR | P02766 | 4/20 | 0.44 |
| ▸ | LIPG | Q9Y5X9 | 10/20 | 0.43 |
| ▸ | LPL | P06858 | 3/20 | 0.43 |
| ▸ | LIPC | P11150 | 4/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | SCD | O00767 | 2/20 | 0.41 |
| ▸ | RBP4 | P02753 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12210053 | 0.88 | NOTUM (0.49) | NOTUMHCRTR2TTRLIPGLPL | |
| Potassium Ion SCHEMBL1410626 | 0.88 | NOTUM (0.58) | NOTUMHCRTR2TTRLIPGLPL | |
| SCHEMBL1409553 | 0.87 | NOTUM (0.48) | NOTUMHCRTR2TTRLIPGLPL | |
| SCHEMBL1410555 | 0.85 | LIPG (0.56) | LIPGLPLLIPC | |
| SCHEMBL1410172 | 0.79 | LIPG (0.53) | LIPGLPLLIPC | |
| SCHEMBL12210095 | 0.78 | NOTUM (0.64) | NOTUMTTRLIPGLPLLIPC | |
| SCHEMBL1410269 | 0.78 | NOTUM (0.59) | NOTUM | |
| SCHEMBL1410436 | 0.77 | NOTUM (0.58) | NOTUMLIPGLPLLIPC | |
| Potassium Ion SCHEMBL1410609 | 0.76 | LIPG (0.56) | LIPGLPLLIPC | |
| Potassium Ion SCHEMBL1410342 | 0.76 | NOTUM (0.58) | NOTUMLIPGLPL |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110251187-A1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-10-13 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20110251187-A1 | HETEROCYCLIC COMPOUND | NES, BMI1, DOT1L | NOTUM 874/4885HCRTR2 1071/4885TTR 4351/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.