Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 5/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.65 |
| ▸ | BRD4 | O60885 | 1/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.65 |
| ▸ | ATM | Q13315 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.50 |
| ▸ | CCR2 | P41597 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | RORC | P51449 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16801846 | 0.88 | KDM4E (0.74) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL16801592 | 0.85 | KDM4E (0.85) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL5205141 | 0.81 | HSD11B1 (0.63) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL5705116 | 0.80 | KDM4E (0.78) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL27201572 | 0.80 | HSD11B1 (0.64) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL18324984 | 0.79 | KDM4E (0.76) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL5705098 | 0.79 | KDM4E (1.00) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL14181451 | 0.79 | KDM4E (0.63) | HSD11B1KDM4EBRD4ALDH1A1POLB | |
| SCHEMBL3066058 | 0.78 | HSD11B1 (0.65) | HSD11B1CCR2 | |
| SCHEMBL16801496 | 0.77 | KDM4E (0.76) | HSD11B1KDM4EBRD4ALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1654253-B1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-01-03 | — | — | EP | claimed |
| EP-1654253-B1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-01-03 | — | — | EP | disclosed |