Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MCHR1 | Q99705 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
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 SCHEMBL11529369 | 0.99 | ALDH1A1 (0.48) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| SCHEMBL11529632 | 0.80 | LMNA (0.50) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| SCHEMBL11526990 | 0.79 | CYP2D6 (0.49) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11528321 | 0.79 | ALDH1A1 (0.51) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11524546 | 0.78 | ALDH1A1 (0.50) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| SCHEMBL11531609 | 0.78 | MCHR1 (0.47) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11528517 | 0.77 | MCHR1 (0.46) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| SCHEMBL11530069 | 0.75 | PPARA (0.48) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL11533364 | 0.74 | CYP3A4 (0.48) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 | |
| SCHEMBL11529384 | 0.74 | THRA (0.47) | ALDH1A1LMNAKDM4ECYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4140770-A | Benzoylethers and processes for their production | A. NATTERMANN & CIE. GMBH (DE) | 1979-02-20 | — | — | US | disclosed |