Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL7797789 | 1.00 | CNR2 (0.44) | CNR2HTTSMN1; SMN2ABCB1ABCC1 | |
| SCHEMBL7186471 | 0.95 | CNR2 (0.39) | CNR2HTTSMN1; SMN2LMNACYP3A4 | |
| SCHEMBL7172563 | 0.84 | CNR2 (0.43) | CNR2HTTSMN1; SMN2ABCB1ABCC1 | |
| Trifluoromethanesulfonic Acid SCHEMBL7190992 | 0.84 | MAPT (0.38) | HTTABCB1ABCC1LMNAMAPT | |
| Trifluoromethanesulfonic Acid SCHEMBL7805711 | 0.84 | MAPT (0.38) | HTTABCB1ABCC1LMNAMAPT | |
| SCHEMBL5433398 | 0.81 | HTT (0.61) | HTTSMN1; SMN2LMNAFFAR1KDM4E | |
| SCHEMBL3144525 | 0.81 | CA12 (0.46) | HTTSMN1; SMN2LMNACYP3A4CYP2D6 | |
| SCHEMBL2964104 | 0.81 | CA12 (0.46) | HTTSMN1; SMN2LMNACYP3A4CYP2D6 | |
| SCHEMBL3143792 | 0.80 | ALDH1A1 (0.48) | HTTSMN1; SMN2LMNAMAPTNPSR1 | |
| SCHEMBL759993 | 0.80 | ALDH1A1 (0.48) | HTTSMN1; SMN2LMNAMAPTNPSR1 |
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-20010033990-A1 | Resist compositions and patterning process | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2001-10-25 | — | — | US | disclosed |