Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 1/20 | 0.61 |
| ▸ | LDHA | P00338 | 1/20 | 0.47 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.44 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | CDC25B | P30305 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | RORB | Q92753 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14398126 | 0.81 | WDR5 (0.58) | WDR5LDHASOS1NR4A1NR4A2 | |
| SCHEMBL31134224 | 0.80 | ERN1 (0.41) | WDR5ERN1ALDH1A1HPGDMEN1 | |
| SCHEMBL895573 | 0.78 | WDR5 (1.00) | WDR5LDHASOS1NR4A1NR4A2 | |
| SCHEMBL29721418 | 0.78 | WDR5 (1.00) | WDR5LDHASOS1NR4A1NR4A2 | |
| SCHEMBL14398058 | 0.77 | KDM4E (0.46) | ERN1ALDH1A1HPGDLMNAKMT2A | |
| SCHEMBL14398192 | 0.75 | MYC (0.51) | NR4A1ALDH1A1HPGDLMNAMCL1 | |
| SCHEMBL967386 | 0.75 | RORC (0.47) | ERN1ALDH1A1MCL1ACMSDMEN1 | |
| SCHEMBL29458346 | 0.75 | WDR5 (0.79) | WDR5LDHASOS1NR4A1NR4A2 | |
| SCHEMBL9124028 | 0.75 | WDR5 (0.79) | WDR5LDHASOS1NR4A1NR4A2 | |
| SCHEMBL8595668 | 0.73 | WDR5 (0.76) | WDR5LDHASOS1NR4A1NR4A2 |
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-2007117180-A1 | AZAHETEROCYCLES, COMBINATORY LIBRARY, FOCUSED LIBRARY, PHARMACEUTICAL COMPOSITION AND METHODS FOR THE PRODUCTION THEREOF | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE' LTD. (RU) | 2007-10-18 | — | — | WO | disclosed |