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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 known ✓ | P11229 | 6/20 | 0.46 |
| ▸ | HTR1A known ✓ | P08908 | 2/20 | 0.46 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.46 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.46 |
| ▸ | CHRNA10 known ✓ | Q9GZZ6 | 1/20 | 0.46 |
| ▸ | CHRNA9 known ✓ | Q9UGM1 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 6/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28171146 | 1.00 | TSHR (0.46) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| Sulfuric Acid SCHEMBL1952726 | 0.95 | TSHR (0.47) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| Sulfuric Acid SCHEMBL1952728 | 0.93 | TSHR (0.46) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| Sulfuric Acid SCHEMBL31228302 | 0.93 | CHRM5 (0.48) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| Sulfuric Acid SCHEMBL27725119 | 0.92 | TSHR (0.44) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| Sulfuric Acid SCHEMBL27994079 | 0.90 | TSHR (0.46) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| SCHEMBL304033 | 0.90 | TSHR (0.43) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| Sulfuric Acid SCHEMBL2790952 | 0.89 | TSHR (0.48) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| SCHEMBL25422044 | 0.89 | TSHR (0.56) | TSHRHPGDCHRM5CHRM1CHRM3 | |
| SCHEMBL20908 | 0.89 | TSHR (0.56) | TSHRHPGDCHRM5CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999050500-A1 | IMPROVING RETENTION AND DRAINAGE IN ALKALINE FINE PAPER | CALLAWAY CORPORATION (US) | 1999-10-07 | — | — | WO | disclosed |