Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | FLT1 | P17948 | 1/20 | 0.33 |
| ▸ | FLT4 | P35916 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL413377 | 0.83 | ALDH1A1 (0.41) | ALDH1A1 | |
| Benzene SCHEMBL8170940 | 0.82 | — | — | |
| Fluorobenzene SCHEMBL27951760 | 0.81 | KMT2A (0.38) | TSHRHSD17B10MAPK1KMT2AMEN1 | |
| Naphthalene SCHEMBL8355966 | 0.80 | CYP2A6 (0.38) | CYP1A2ALDH1A1CES2CES1CYP3A4 | |
| Parachlorophenol SCHEMBL6763643 | 0.80 | MAPK1 (0.44) | SMN1; SMN2CYP1A2ALDH1A1CYP3A4MAPK1 | |
| Iodobenzene SCHEMBL28293584 | 0.79 | PTGS2 (0.32) | — | |
| Toluene SCHEMBL2923984 | 0.79 | LMNA (0.46) | TSHRTDP1SMN1; SMN2CYP1A2ALDH1A1 | |
| SCHEMBL10584897 | 0.79 | SRC (0.31) | — | |
| Phenol SCHEMBL9645845 | 0.79 | TDP1 (0.46) | TSHRTDP1SMN1; SMN2CES2KMT2A | |
| Diphenylether SCHEMBL16004650 | 0.78 | LTA4H (0.48) | TSHRSMN1; SMN2CES2CES1PGR |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103193715-A | Preparation method of 5,6-dihydropyrimidone derivative | UNIV ZHEJIANG | 2013-07-10 | — | — | CN | disclosed |
| CN-101296699-B | Pyrazolo [1,5-a ] pyrimidine compounds | MITSUBISHI TANABE PHARMA CORP | 2013-01-02 | — | — | CN | disclosed |
| CN-101296699-A | Pyrazolo [1, 5-a ] pyrimidine compounds | MITSUBISHI TANABE PHARMA CORP (JP) | 2008-10-29 | — | — | CN | disclosed |
| CN-1288887-A | Monopotassium salt and dipotassium salt of azo-compound | BAYER AG (DE) | 2001-03-28 | — | — | CN | disclosed |
| EP-0606105-B1 | Nitro-substituted heterocyclic compounds as insecticides | BAYER AGROCHEM KK (JP) | 1998-11-25 | — | — | EP | disclosed |
| CN-1092066-A | The 6-methyl isophthalic acid, 2,3-Evil thiazine-4 (3H)-ketone-2, the synthetic method of 2-dioxide and salt thereof | SCIENCES INST MINISTRY OF COMM (CN) | 1994-09-14 | — | — | CN | disclosed |
| EP-0606105-A1 | Nitro-substituted heterocyclic compounds as insecticides | NIHON BAYER AGROCHEM K.K. (JP) | 1994-07-13 | — | — | EP | disclosed |
| US-5314897-A | Insecticide | NIHON BAYER AGROCHEM K.K. (JP) | 1994-05-24 | — | — | US | disclosed |
| US-5219869-A | Insecticides | NIHON BAYER AGROCHEM K.K. (JP) | 1993-06-15 | — | — | US | disclosed |
| US-5081132-A | Insecticides | NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) | 1992-01-14 | — | — | US | disclosed |
| EP-0398084-A2 | Nitro-substituted heterocyclic compounds | NIHON BAYER AGROCHEM K.K. (JP) | 1990-11-22 | — | — | EP | disclosed |