Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.50 |
| ▸ | CCR6 | P51684 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 7/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11408704 | 0.98 | KCNH2 (0.49) | KCNH2CCR6MAPTKMT2AATM | |
| SCHEMBL14000465 | 0.88 | ATM (0.51) | KCNH2CCR6ATML3MBTL1CHRM3 | |
| SCHEMBL954586 | 0.88 | ATM (0.51) | KCNH2CCR6ATML3MBTL1CHRM3 | |
| SCHEMBL954588 | 0.88 | ATM (0.51) | KCNH2CCR6ATML3MBTL1CHRM3 | |
| SCHEMBL11400449 | 0.83 | MAPT (0.42) | KCNH2MAPTKMT2ACHRM3CHRM4 | |
| SCHEMBL11405464 | 0.83 | CHRM3 (0.47) | KCNH2MAPTKMT2ACHRM3CHRM4 | |
| SCHEMBL11403479 | 0.79 | CYP2D6 (0.44) | KCNH2MAPTKMT2ACHRM3CHRM4 | |
| SCHEMBL11397743 | 0.77 | KEAP1 (0.42) | KCNH2CHRM3CHRM4CHRM2ADRB2 | |
| SCHEMBL10869251 | 0.77 | CHRM3 (0.60) | KCNH2CHRM3CHRM4CHRM2ADRB2 | |
| SCHEMBL11834928 | 0.76 | ACKR3 (0.47) | KCNH2ATML3MBTL1CHRM3CHRM4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4296037-A | 4,5-Dihydro-3,3-diphenyl-4-hydrocarbylaminomethylfuran-2(3H) ones | A. H. ROBINS COMPANY, INCORPORATED (US) | 1981-10-20 | — | — | US | disclosed |
| US-4260606-A | ANTIDEPRESSANTS | A. H. ROBINS COMPANY, INC. (US) | 1981-04-07 | — | — | US | disclosed |
| US-4242261-A | REACTING AN A,A-DIPHENYL-A-N-HETEROCYCLIC ACETAMIDE WITH BROMINE AND AN ALKALI METAL ALKOXIDE AND HEATING | A. H. ROBINS COMPANY, INC. (US) | 1980-12-30 | — | — | US | disclosed |
| US-4144245-A | 4-Hydroxymethyl-2-pyrrolidinones | A. H. ROBINS COMPANY, INC. (US) | 1979-03-13 | — | — | US | disclosed |
| US-4119637-A | 4-Hydroxymethyl-2-pyrrolidinones | A. H. ROBINS COMPANY, INC. (US) | 1978-10-10 | — | — | US | disclosed |