Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 2/20 | 0.32 |
| ▸ | MGLL | Q99685 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL22909374 | 0.85 | TAAR1 (0.39) | ALDH1A1KDM4ESMN1; SMN2TSHRCA12 | |
| SCHEMBL22909382 | 0.83 | SIGMAR1 (0.40) | CA12CA1CA2CA7CA13 | |
| SCHEMBL22909164 | 0.77 | CA12 (0.49) | ALDH1A1TSHRCA12CA1CA2 | |
| SCHEMBL15104760 | 0.75 | CALM1 (0.55) | ALDH1A1KDM4ECALM1TSHRLTA4H | |
| SCHEMBL22909609 | 0.72 | SIGMAR1 (0.31) | — | |
| SCHEMBL22909179 | 0.71 | TSHR (0.35) | ALDH1A1KDM4ETSHRMGLL | |
| SCHEMBL22909384 | 0.70 | TYMP (0.33) | — | |
| SCHEMBL22909268 | 0.70 | ALDH1A1 (0.41) | ALDH1A1KDM4ECYP2D6HRH1 | |
| SCHEMBL22909233 | 0.70 | GFER (0.42) | ALDH1A1TSHRAOC3TAAR1 | |
| SCHEMBL22909466 | 0.68 | HDAC11 (0.39) | ALDH1A1KDM4ESMN1; SMN2TSHRCA12 |
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-2021009568-A1 | BENZENESULFONAMIDE DERIVATIVES AND USES THEREOF | 2692372 ONTARIO, INC. (CA) | 2021-01-21 | — | — | WO | disclosed |