Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 6/20 | 0.51 |
| ▸ | BACE1 | P56817 | 6/20 | 0.51 |
| ▸ | BCHE | P06276 | 4/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAOB | P27338 | 2/20 | 0.49 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CXCR3 | P49682 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21101096 | 0.85 | BCHE (0.62) | ACHEBACE1BCHESIGMAR1CXCR3 | |
| SCHEMBL28169202 | 0.84 | CXCR4 (0.68) | ALDH1A1ACHEBACE1BCHESIGMAR1 | |
| SCHEMBL21101241 | 0.82 | ACHE (0.48) | ACHEBACE1BCHEKDM1AMEN1 | |
| SCHEMBL21101233 | 0.82 | SIGMAR1 (0.50) | ACHEBACE1BCHESIGMAR1KDM1A | |
| SCHEMBL21101338 | 0.81 | CXCR4 (0.49) | ACHEBACE1BCHEKDM1AMEN1 | |
| SCHEMBL21100972 | 0.81 | CXCR4 (0.49) | ACHEBACE1BCHESIGMAR1KDM1A | |
| SCHEMBL21101256 | 0.80 | SIGMAR1 (0.52) | ACHEBACE1SIGMAR1KDM1AMAOB | |
| SCHEMBL19725557 | 0.80 | KDM1A (0.67) | KDM1AMEN1KMT2AMAOBCXCR4 | |
| SCHEMBL21100976 | 0.79 | KDM1A (0.44) | ACHEBACE1BCHEKDM1AMEN1 | |
| SCHEMBL3311538 | 0.79 | ACHE (0.68) | ACHEBACE1BCHESIGMAR1KDM1A |
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-2688568-B1 | CYCLOPROPYLAMINES AS LSD1 INHIBITORS | GLAXOSMITHKLINE IP NO 2 LTD (GB) | 2019-06-19 | — | — | EP | disclosed |
| WO-2019075327-A1 | TREATING MERKEL CELL CARCINOMA | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2019-04-18 | — | — | WO | disclosed |