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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA5A | P35218 | 2/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | NT5E | P21589 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11351756 | 0.79 | — | — | |
| SCHEMBL905424 | 0.79 | — | — | |
| SCHEMBL246838 | 0.78 | CA2 (0.58) | CA2CA5ACA5BKDM4ECYP3A4 | |
| SCHEMBL128169 | 0.78 | — | — | |
| SCHEMBL25599 | 0.78 | CA2 (0.58) | CA2CA5ACA5BKDM4ECYP3A4 | |
| SCHEMBL8596055 | 0.78 | CA2 (0.58) | CA2CA5ACA5BKDM4ECYP3A4 | |
| SCHEMBL15109974 | 0.78 | — | — | |
| SCHEMBL105 | 0.78 | — | — | |
| Tert-Butylamine SCHEMBL17746599 | 0.77 | CA2 (0.41) | CA2CA5ACA5BKDM4ECYP3A4 | |
| SCHEMBL429367 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2223957-B1 | Transparent composite compound | KOREA ADVANCED INST SCI & TECH (KR) | 2013-06-26 | — | — | EP | disclosed |
| US-8372504-B2 | Transparent composite compound | KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2013-02-12 | — | — | US | disclosed |
| EP-2223957-A1 | Transparent composite compound | Korea Advanced Institute of Science and Technology (KR) | 2010-09-01 | — | — | EP | disclosed |
| US-20100178478-A1 | TRANSPARENT COMPOSITE COMPOUND | KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (JP) | 2010-07-15 | — | — | US | disclosed |