Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TACR3 | P29371 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 SCHEMBL9544492 | 0.80 | BCHE (0.42) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL28053317 | 0.70 | KDM4E (0.51) | KDM4EALDH1A1POLBCYP1A2CYP3A4 | |
| SCHEMBL9541655 | 0.69 | CCR1 (0.47) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL9544488 | 0.66 | DRD4 (0.43) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL14114235 | 0.66 | MEN1 (0.42) | KDM4EALDH1A1POLBNPC1RAB9A | |
| SCHEMBL9369148 | 0.65 | DRD4 (0.43) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL9369565 | 0.65 | DRD4 (0.42) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL15759146 | 0.64 | KDM4E (0.57) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL1509445 | 0.64 | KDM4E (0.57) | DRD4NPY5RKDM4EALDH1A1BCHE | |
| SCHEMBL9368974 | 0.64 | NPY5R (0.60) | DRD4NPY5RKDM4EALDH1A1BCHE |
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-1993014080-A1 | BRIDGED HETEROCYCLIC FUNGICIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-07-22 | — | — | WO | disclosed |