Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19088938 | 0.92 | FAAH (0.50) | FAAHMEN1KMT2ATDP1TP53 | |
| SCHEMBL611760 | 0.79 | FAAH (0.63) | FAAHMEN1KMT2ATDP1ALDH1A1 | |
| SCHEMBL19066596 | 0.79 | FAAH (0.63) | FAAHMEN1KMT2ATDP1ALDH1A1 | |
| SCHEMBL30889265 | 0.76 | PRMT6 (0.57) | FAAHTDP1ALDH1A1KDM4EACHE | |
| SCHEMBL610620 | 0.76 | PRMT6 (0.57) | FAAHTDP1ALDH1A1KDM4EACHE | |
| SCHEMBL817090 | 0.75 | SMN1; SMN2 (0.58) | FAAHTDP1ALDH1A1KDM4EACHE | |
| SCHEMBL609148 | 0.75 | SMN1; SMN2 (0.58) | FAAHTDP1ALDH1A1KDM4EACHE | |
| SCHEMBL19066585 | 0.74 | FAAH (0.57) | FAAHKMT2AALDH1A1KDM4ESIGMAR1 | |
| SCHEMBL7561071 | 0.73 | TP53 (0.54) | TDP1TP53ALDH1A1 | |
| SCHEMBL23916559 | 0.73 | MC4R (0.57) | FAAHTP53PRMT6SIGMAR1NPC1 |
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-2017116272-A1 | METHOD FOR PREPARING TERTIARY AMINES COMPRISING ETHYNYLBENZYL SUBSTITUENTS | PUBLIC JOINT STOCK COMPANY "SIBUR HOLDING" (RU) | 2017-07-06 | — | — | WO | disclosed |