Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14934251 | 0.85 | PARP1 (0.57) | PARP1ALDH1A1KMT2AMEN1HCAR3 | |
| SCHEMBL14934265 | 0.84 | ALDH1A1 (0.50) | PARP1HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL15208952 | 0.82 | PARP1 (0.64) | PARP1ALDH1A1KMT2AMEN1HCAR3 | |
| SCHEMBL14934242 | 0.82 | PARP1 (0.54) | PARP1HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL14934271 | 0.81 | HTT (0.46) | HTTALDH1A1KMT2AMEN1HCAR3 | |
| SCHEMBL14934240 | 0.80 | PARP1 (0.51) | PARP1ALDH1A1HCAR3GAAHPGD | |
| SCHEMBL27901177 | 0.79 | PARP1 (0.69) | PARP1HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL14934211 | 0.78 | PARP1 (0.56) | PARP1HTTALDH1A1KMT2AMEN1 | |
| SCHEMBL14934237 | 0.78 | MAPT (0.51) | PARP1ALDH1A1HCAR3GAANPC1 | |
| SCHEMBL14934252 | 0.77 | HDAC1 (0.52) | PARP1ALDH1A1HCAR3GAASMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103086925-A | Benzoyl urea derivatives having anticancer activity and their preparation method and use | ZHEJIANG HISUN PHARM CO LTD | 2013-05-08 | — | — | CN | claimed |
| WO-2013064029-A1 | BENZOYLUREA DERIVATIVE WITH ANTICANCER ACTIVITY AND PREPARATION METHOD AND USE THEREOF | 浙江海正药业股份有限公司 (CN) | 2013-05-10 | — | — | WO | disclosed |
| CN-103086925-A | Benzoyl urea derivatives having anticancer activity and their preparation method and use | ZHEJIANG HISUN PHARM CO LTD | 2013-05-08 | — | — | CN | disclosed |