Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5818954 | 0.80 | HSD17B10 (0.46) | IMPDH2MAPK1NR4A2HSD17B10ALDH1A1 | |
| SCHEMBL21380893 | 0.75 | FFAR1 (0.36) | NR4A2HTR2A | |
| SCHEMBL9739074 | 0.72 | LIMK1 (0.41) | MAPK1HSD17B10PARP1ALDH1A1HTR2A | |
| SCHEMBL3482926 | 0.71 | ATM (0.47) | — | |
| SCHEMBL3928782 | 0.71 | GPR84 (0.36) | NR4A2 | |
| SCHEMBL1450915 | 0.70 | MEN1 (0.41) | HSD17B10ALDH1A1MAPTMEN1KMT2A | |
| 3-Phenylindole SCHEMBL84056 | 0.70 | IMPDH2 (0.71) | IMPDH2MAPK1NR4A2HSD17B10PARP1 | |
| 3-Phenylindole SCHEMBL29609072 | 0.70 | IMPDH2 (0.71) | IMPDH2MAPK1NR4A2HSD17B10PARP1 | |
| SCHEMBL1923969 | 0.68 | PARP1 (0.58) | IMPDH2MAPK1NR4A2HSD17B10PARP1 | |
| SCHEMBL2256009 | 0.67 | TNF (0.39) | MAPK1HSD17B10ALDH1A1MAPTMEN1 |
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-2655359-A1 | CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT | Johannes-Gutenberg-Universität Mainz (DE) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012084683-A1 | CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT | Johannes Gutenberg-Universität Mainz (DE) | 2012-06-28 | — | — | WO | disclosed |