Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.33 |
| ▸ | CTSL | P07711 | 1/20 | 0.33 |
| ▸ | CTSB | P07858 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7747533 | 0.78 | ITGB3 (0.46) | SMN1; SMN2CYP2C19NPC1CYP2D6CYP2C9 | |
| SCHEMBL7398369 | 0.77 | GRIN2B (0.35) | MEN1KMT2AGRIN2BCYP2D6CYP2C9 | |
| SCHEMBL7448545 | 0.76 | SMN1; SMN2 (0.53) | SMN1; SMN2CYP2C19NPC1MEN1KMT2A | |
| SCHEMBL7403343 | 0.75 | CTSL (0.36) | CTSLCTSBCTSK | |
| SCHEMBL9796122 | 0.72 | ALDH1A1 (0.38) | BCHESMN1; SMN2CYP2C19NPC1 | |
| SCHEMBL8552418 | 0.72 | MGLL (0.35) | BCHEACHESMN1; SMN2CYP2C19NPC1 | |
| SCHEMBL8549475 | 0.71 | SMN1; SMN2 (0.65) | SMN1; SMN2CYP2C19NPC1MEN1KMT2A | |
| SCHEMBL8552420 | 0.71 | BCHE (0.45) | BCHEACHELMNA | |
| SCHEMBL9204131 | 0.70 | CTSL (0.36) | MEN1KMT2ACTSLCTSBCTSK | |
| SCHEMBL27613312 | 0.70 | KDM4E (0.36) | SMN1; SMN2KMT2AGRIN2B |
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-0858457-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | Dr. Karl Thomae GmbH (DE) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997015567-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | DR. KARL THOMAE GMBH (DE) | 1997-05-01 | — | — | WO | disclosed |