Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.39 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.39 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.39 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13746392 | 0.90 | GAA (0.56) | ACACBGAAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL4634787 | 0.85 | ACACB (0.44) | ACACBGAASMN1; SMN2CHRNB2CHRNB4 | |
| SCHEMBL12696525 | 0.82 | CHRNB2 (0.56) | ACACBKDM4ESMN1; SMN2CHRNB2CHRNB4 | |
| SCHEMBL16036865 | 0.82 | CHRNB2 (0.56) | ACACBKDM4ESMN1; SMN2CHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL2146410 | 0.81 | CHRNB2 (0.54) | ACACBKDM4ESMN1; SMN2CHRNB2CHRNB4 | |
| Hydrochloric Acid SCHEMBL2146404 | 0.81 | CHRNB2 (0.54) | ACACBKDM4ESMN1; SMN2CHRNB2CHRNB4 | |
| SCHEMBL23480154 | 0.80 | GAA (0.65) | ACACBGAAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL14241975 | 0.80 | GAA (0.65) | ACACBGAAALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL24063090 | 0.80 | ACACB (0.41) | ACACBGAAKDM4ECHRNB2CHRNB4 | |
| SCHEMBL12574191 | 0.77 | GNAI3 (0.51) | ACACBALDH1A1KDM4ESMN1; SMN2CHRNB2 |
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-1638933-B1 | N-PYRROLIDIN-3-YL-AMIDE DERIVATIVES AS SEROTONIN AND NORADRENALINE RE-UPTAKE INHIBITORS | PFIZER LTD (GB) | 2008-06-11 | — | — | EP | claimed |