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 | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.56 |
| ▸ | CA2 | P00918 | 4/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | CA4 | P22748 | 1/20 | 0.56 |
| ▸ | CA6 | P23280 | 1/20 | 0.56 |
| ▸ | CA5A | P35218 | 1/20 | 0.56 |
| ▸ | CA7 | P43166 | 1/20 | 0.56 |
| ▸ | CA9 | Q16790 | 1/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.56 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.56 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.42 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23803137 | 0.89 | CA1 (0.57) | CA1CA2CA12CA4CA6 | |
| Benzyl Alcohol SCHEMBL1875625 | 0.87 | TSHR (0.67) | CA1CA2CA12CA4CA6 | |
| SCHEMBL7786897 | 0.85 | ALDH1A1 (0.46) | CA1CA2CA12CA4CA6 | |
| Pyridine 4-Methanol SCHEMBL10764084 | 0.84 | ALDH1A1 (0.51) | CA1CA2CA12CA4CA6 | |
| SCHEMBL96651 | 0.82 | PTGS2 (0.68) | CA1CA2CA12CA4CA6 | |
| SCHEMBL710399 | 0.82 | CA1 (0.50) | CA1CA2CA12CA4CA6 | |
| SCHEMBL7230378 | 0.82 | KMT2A (0.65) | CA1CA2CA12CA4CA6 | |
| SCHEMBL5742854 | 0.82 | HPGD (0.70) | CA1CA2CA12CA9KDM4E | |
| SCHEMBL8063115 | 0.80 | IKBKB (0.47) | TSHRALDH1A1ADAMTS4PRSS1PRSS2 | |
| SCHEMBL259654 | 0.79 | CA2 (0.52) | CA1CA2CA12CA4CA6 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111154098-B | Polyelectrolyte, preparation method and application thereof | 湘潭大学 | 2022-07-05 | — | — | CN | claimed |
| CN-111087614-A | Reticular polymer and preparation method and application thereof | 湘潭大学 | 2020-05-01 | — | — | CN | claimed |
| CN-111087614-B | Reticular polymer and preparation method and application thereof | 湘潭大学 | 2022-07-15 | — | — | CN | disclosed |
| CN-111154098-B | Polyelectrolyte, preparation method and application thereof | 湘潭大学 | 2022-07-05 | — | — | CN | disclosed |
| CN-111154098-A | Polyelectrolyte, preparation method and application thereof | 湘潭大学 | 2020-05-15 | — | — | CN | disclosed |
| CN-111087614-A | Reticular polymer and preparation method and application thereof | 湘潭大学 | 2020-05-01 | — | — | CN | disclosed |
| US-6013407-A | PHOTORESISTS WITH PHENOLIC RESINS, QUINONEDIAZIDE SULFONATES, PHOTOSENSITIVE AGENTS AND PHENOLIC COMPOUNDS | NIPPON ZEON CO., LTD. (JP) | 2000-01-11 | — | — | US | disclosed |
| EP-0831370-A1 | POSITIVE RESIST COMPOSITION | NIPPON ZEON CO., LTD. (JP) | 1998-03-25 | — | — | EP | disclosed |