Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.34 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8154592 | 0.72 | — | — | |
| SCHEMBL13986698 | 0.72 | MEN1 (0.35) | SLC22A12MEN1KMT2AL3MBTL1CYP11B1 | |
| SCHEMBL3675779 | 0.70 | CYP11B1 (0.35) | SLC22A12KDM4EMEN1KMT2AL3MBTL1 | |
| SCHEMBL31482498 | 0.69 | — | — | |
| SCHEMBL7832446 | 0.69 | KDM4E (0.42) | KDM4EMEN1KMT2AL3MBTL1PPARG | |
| SCHEMBL17591656 | 0.69 | KDM4E (0.41) | KDM4EMEN1KMT2AL3MBTL1PPARG | |
| SCHEMBL18874068 | 0.69 | ADORA2A (0.47) | KDM4EMEN1KMT2AL3MBTL1PPARG | |
| SCHEMBL10460219 | 0.69 | SLC22A12 (0.45) | SLC22A12KDM4EMEN1KMT2ANPSR1 | |
| SCHEMBL6643072 | 0.68 | — | — | |
| SCHEMBL31352013 | 0.68 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111471021-B | Substituted diamino carboxamides and diamino carbonitrile pyrimidines, compositions thereof, and methods of treatment therewith | 西格诺药品有限公司 | 2024-04-02 | — | — | CN | disclosed |
| US-5304647-A | Addition of an organolithium reagent; dehydrogenation of addition product; two-phase conditions prevents hydrolysis | GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) | 1994-04-19 | — | — | US | disclosed |
| US-4963676-A | INTERMEDIATES FOR NOVEL UNFUSED HETEROBICYCLIC COMPOUNDS WITH BIOLOGICAL ACTIVITY; ANTICANCER AGENTS | GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) | 1990-10-16 | — | — | US | disclosed |
| US-4929726-A | ANTICARCINOGENIC AGENTS | GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) | 1990-05-29 | — | — | US | disclosed |
| WO-1989007599-A2 | NOVEL DIAZINES AND THEIR METHOD OF PREPARATION | GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) | 1989-08-24 | — | — | WO | disclosed |