Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.39 |
| ▸ | PDE2A | O00408 | 2/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.39 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SCN4A | P35499 | 2/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10693333 | 0.91 | IDH1 (0.36) | PDE10APDE2APDE7APDE11ACYP1A2 | |
| SCHEMBL10694763 | 0.83 | KDM4E (0.33) | CYP1A2SCN5AKDM4EALDH1A1HPGD | |
| SCHEMBL10696167 | 0.82 | PGK1 (0.32) | — | |
| SCHEMBL10693091 | 0.80 | TRPV1 (0.33) | KDM4EALDH1A1HPGD | |
| SCHEMBL10691690 | 0.78 | KCNH2 (0.39) | CYP1A2NPC1RAB9ALMNACYP2C9 | |
| SCHEMBL10694821 | 0.78 | SCN5A (0.36) | CYP1A2SCN5ALMNACYP3A4CYP2C9 | |
| SCHEMBL15730236 | 0.77 | PPARG (0.45) | PDE10APDE2APDE7APDE11ACYP1A2 | |
| SCHEMBL10695942 | 0.77 | ALDH1A1 (0.48) | CYP1A2LMNATP53CYP3A4CYP2C9 | |
| SCHEMBL10693958 | 0.76 | SCN5A (0.36) | PDE2ACYP1A2SCN5ACYP2C9SMN1; SMN2 | |
| SCHEMBL18854019 | 0.74 | KMT2A (0.44) | PDE10APDE2APDE7APDE11ACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0251012-A2 | N-sulfenyl-2-trifluoromethyl benzimidazoles | BAYER AG (DE) | 1988-01-07 | — | — | EP | disclosed |