Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.69 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.69 |
| ▸ | NPC1 | O15118 | 6/20 | 0.64 |
| ▸ | RAB9A | P51151 | 6/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.64 |
| ▸ | GAA | P10253 | 4/20 | 0.64 |
| ▸ | TP53 | P04637 | 2/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | GLA | P06280 | 1/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.63 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.63 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.63 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL30362638 | 1.00 | MEN1 (0.69) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL30643216 | 0.89 | MEN1 (0.63) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL6815217 | 0.85 | KMT2A (0.61) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL27487339 | 0.84 | MEN1 (0.57) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL8129469 | 0.84 | MEN1 (0.57) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL20332736 | 0.82 | SORT1 (0.71) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL17675194 | 0.81 | MEN1 (0.71) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL8433498 | 0.81 | MEN1 (1.00) | MEN1KMT2AKDM4EL3MBTL1NPC1 | |
| SCHEMBL23446474 | 0.80 | SMN1; SMN2 (0.56) | MEN1KMT2AKDM4ENPC1RAB9A | |
| SCHEMBL1966818 | 0.80 | SMN1; SMN2 (0.64) | MEN1KMT2AKDM4EL3MBTL1NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113735850-A | Synthesis method of 1,2, 4-triazole compound | 河南师范大学 | 2021-12-03 | — | — | CN | disclosed |
| EP-2734529-A1 | BTK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2014-05-28 | — | — | EP | disclosed |
| WO-2013010380-A1 | BTK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2013-01-24 | — | — | WO | disclosed |
| CN-1177356-A | Bicyclic benzazepine derivatives as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-03-25 | — | — | CN | disclosed |