Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 3/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CCR5 | P51681 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 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 | |
|---|---|---|---|---|
| SCHEMBL28069484 | 0.71 | CCR5 (0.33) | KDM4EPKMEPHX2CCR5TSHR | |
| SCHEMBL28069467 | 0.64 | PTPN1 (0.48) | CYP2C9PTPN1KDM4EALDH1A1TSHR | |
| SCHEMBL17494409 | 0.63 | TAS1R3 (0.37) | TSHRTAS1R3TAS1R1TAS1R2 | |
| SCHEMBL4998879 | 0.63 | MAPT (0.44) | PTPN1HTTUSP2ALDH1A1NPSR1 | |
| SCHEMBL6655919 | 0.61 | EPHX2 (0.36) | KDM4EEPHX2HTTALDH1A1HSD17B10 | |
| SCHEMBL17194898 | 0.61 | CNR1 (0.60) | CNR1CNR2ALDH1A1SMN1; SMN2TAS1R3 | |
| SCHEMBL13280329 | 0.60 | KDM4E (0.56) | KDM4EALDH1A1TSHRNPSR1HSD17B10 | |
| SCHEMBL5202907 | 0.60 | MAPT (0.47) | KDM4EHTTALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL27833662 | 0.60 | PTPN1 (1.00) | PTPN1KDM4EHTTALDH1A1TSHR | |
| SCHEMBL4726889 | 0.60 | EGFR (0.43) | NPSR1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105801482-A | Method for preparing 1-cyclopropyl-4-oxo-7-bromine-8-difluoromethoxy-1,4-dihydro-quinoline-3-nonanoic acid-ethyl ester | 浙江中欣氟材股份有限公司 | 2016-07-27 | — | — | CN | claimed |
| CN-105777631-A | Synthesizing method of 1-cyclopropyl-4-oxo-7-bromo-8-difluoromethoxy-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester | 浙江中欣氟材股份有限公司 | 2016-07-20 | — | — | CN | claimed |