Known targets — ChEMBL curated mechanism
ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol
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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 6/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FDPS | P14324 | 1/20 | 0.36 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL306924 | 1.00 | DNM1 (0.55) | DNM1CA2RECQLTSHRMAPK1 | |
| SCHEMBL3780740 | 0.93 | DNM1 (0.68) | DNM1CA2RECQLTSHRMAPK1 | |
| SCHEMBL832250 | 0.93 | DNM1 (0.68) | DNM1CA2RECQLTSHRMAPK1 | |
| Sulfuric Acid SCHEMBL3698695 | 0.92 | DNM1 (0.57) | DNM1CA2RECQLTSHRMAPK1 | |
| SCHEMBL19305252 | 0.91 | DNM1 (0.46) | DNM1CA2RECQLTSHRMAPK1 | |
| SCHEMBL7128039 | 0.90 | DNM1 (0.64) | DNM1CA2RECQLTSHRMAPK1 | |
| SCHEMBL829599 | 0.90 | DNM1 (0.64) | DNM1CA2RECQLTSHRMAPK1 | |
| Sulfuric Acid SCHEMBL7638378 | 0.90 | DNM1 (0.55) | DNM1CA2RECQLTSHRMAPK1 | |
| Sulfuric Acid SCHEMBL7172618 | 0.90 | DNM1 (0.55) | DNM1CA2RECQLTSHRMAPK1 | |
| Sulfuric Acid SCHEMBL7637278 | 0.90 | DNM1 (0.55) | DNM1CA2RECQLTSHRMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9309471-B2 | Decontamination of deoxygenated biomass-derived pyrolysis oil using ionic liquids | UOP LLC (US) | 2016-04-12 | — | — | US | claimed |
| WO-2014003943-A1 | DECONTAMINATION OF DEOXYGENATED BIOMASS-DERIVED PYROLYSIS OIL USING IONIC LIQUIDS | UOP LLC (US) | 2014-01-03 | — | — | WO | claimed |
| US-20140005451-A1 | DECONTAMINATION OF DEOXYGENATED BIOMASS-DERIVED PYROLYSIS OIL USING IONIC LIQUIDS | UOP LLC (US) | 2014-01-02 | — | — | US | claimed |