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 | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
| ▸ | GRIA1 | P42261 | 3/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL576878 | 0.93 | CA5A (0.40) | CA2CA1POLBALDH1A1KDM4E | |
| Sulfuric Acid SCHEMBL8079703 | 0.90 | CA5A (0.38) | CA2CA1POLBALDH1A1KDM4E | |
| Thiosulfuric Acid SCHEMBL11126661 | 0.88 | CA1 (0.33) | CA2CA1POLB | |
| Sulfuric Acid SCHEMBL11574272 | 0.85 | CA5A (0.33) | CA2CA1POLBALDH1A1KDM4E | |
| SCHEMBL1132267 | 0.84 | CA2 (0.35) | CA2CA1POLBALDH1A1KDM4E | |
| SCHEMBL3018307 | 0.83 | CA14 (0.34) | CA2CA1 | |
| Isopropyl Alcohol SCHEMBL9431191 | 0.82 | — | — | |
| SCHEMBL575531 | 0.82 | CA2 (0.44) | CA2CA1POLBALDH1A1KDM4E | |
| SCHEMBL37338 | 0.82 | ALDH1A1 (0.46) | ALDH1A1LMNATDP1TP53 | |
| SCHEMBL3294617 | 0.79 | CA1 (0.32) | CA2CA1POLB |
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-20210403646-A1 | ACID-CURABLE COMPOSITION | 3M INNOVATIVE PROPERTIES COMPANY | 2021-12-30 | — | — | US | disclosed |
| CN-113166407-A | Acid curable composition | 3M创新有限公司 | 2021-07-23 | — | — | CN | disclosed |
| EP-3650486-A1 | ACID-CURABLE COMPOSITION | 3M Innovative Properties Company (US) | 2020-05-13 | — | — | EP | disclosed |