Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.53 |
| ▸ | CHRNB2 | P17787 | 7/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 7/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2524847 | 0.71 | CHRNB2 (0.52) | MAPTMEN1KMT2AKDM4EMAPK1 | |
| SCHEMBL29804975 | 0.67 | CHRNB2 (0.56) | MEN1KMT2ACHRNB2CHRNA4CHRNA7 | |
| SCHEMBL10663996 | 0.67 | ALDH1A1 (0.64) | MAPTKMT2AKDM4EMAPK1SMN1; SMN2 | |
| SCHEMBL15800659 | 0.67 | MEN1 (0.47) | MAPTMEN1KMT2AKDM4EMAPK1 | |
| SCHEMBL27467551 | 0.65 | — | — | |
| Water SCHEMBL4803706 | 0.63 | CYP11B2 (0.61) | MAPTKMT2AMAPK1CHRNB2CHRNA4 | |
| SCHEMBL29434996 | 0.63 | — | — | |
| SCHEMBL2014183 | 0.63 | CYP11B2 (0.61) | MAPTKMT2AMAPK1CHRNB2CHRNA4 | |
| SCHEMBL28776 | 0.63 | — | — | |
| Water SCHEMBL28116587 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5712408-A | Diaminomaleonitrile derivative compounds, polymers, and method of producing same | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 1998-01-27 | — | — | US | disclosed |