Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | TLR4 | O00206 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.39 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
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 SCHEMBL11794844 | 0.99 | ACHE (0.41) | ACHETLR4XDHNLRP3CLK1 | |
| SCHEMBL11796999 | 0.90 | MAPT (0.43) | ACHETLR4XDHNLRP3LMNA | |
| SCHEMBL15158081 | 0.80 | MAPT (0.56) | ACHESMN1; SMN2KDM4ELCKMAPT | |
| Hydrochloric Acid SCHEMBL11797894 | 0.80 | ESR1 (0.44) | ACHE | |
| SCHEMBL10477505 | 0.76 | LMNA (0.51) | LMNASMN1; SMN2GAAKDM4EMAPT | |
| SCHEMBL26083923 | 0.76 | ACHE (0.47) | ACHELMNAKDM4ECHRNA7HTR3A | |
| SCHEMBL26729524 | 0.75 | TSHR (0.46) | ACHEGAAKDM4ELCKMAPT | |
| Hydrochloric Acid SCHEMBL11786998 | 0.75 | LMNA (0.50) | LMNASMN1; SMN2GAAKDM4EMAPT | |
| SCHEMBL11798029 | 0.73 | MAPT (0.51) | ACHELMNASMN1; SMN2GAAKDM4E | |
| SCHEMBL1940345 | 0.72 | ACHE (0.45) | ACHELMNAKDM4ECHRNA7HTR3A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3948928-A | ANTI-RESERPINE, CNS DEPRESSANT, HYPOTENSIVE, L-DOPA POTENTIATORS | DAINIPPON PHARMACEUTICAL CO., LTD. (JA) | 1976-04-06 | — | — | US | claimed |
| US-3948928-A | ANTI-RESERPINE, CNS DEPRESSANT, HYPOTENSIVE, L-DOPA POTENTIATORS | DAINIPPON PHARMACEUTICAL CO., LTD. (JA) | 1976-04-06 | — | — | US | disclosed |