Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of 1,2-Naphthoquinone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRC | P08575 | 6/20 | 0.77 |
| ▸ | CES1 | P23141 | 3/20 | 0.77 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.77 |
| ▸ | MAPT | P10636 | 3/20 | 0.77 |
| ▸ | IDO1 | P14902 | 2/20 | 0.77 |
| ▸ | MEN1 | O00255 | 2/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.77 |
| ▸ | HPGD | P15428 | 2/20 | 0.77 |
| ▸ | PTPN22 | Q9Y2R2 | 2/20 | 0.77 |
| ▸ | POLB | P06746 | 2/20 | 0.77 |
| ▸ | THRB | P10828 | 2/20 | 0.77 |
| ▸ | RECQL | P46063 | 2/20 | 0.77 |
| ▸ | LMNA | P02545 | 1/20 | 0.77 |
| ▸ | BCHE | P06276 | 1/20 | 0.77 |
| ▸ | PKM | P14618 | 1/20 | 0.77 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.77 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.77 |
| ▸ | ACHE | P22303 | 1/20 | 0.77 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.77 |
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 | |
|---|---|---|---|---|
| 1,2-Naphthoquinone SCHEMBL28008660 | 0.90 | PTPRC (0.95) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL27880732 | 0.88 | PTPRC (0.91) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL173316 | 0.88 | PTPRC (1.00) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL15167712 | 0.88 | PTPRC (1.00) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL29363665 | 0.88 | PTPRC (1.00) | PTPRCCES1KDM4EALDH1A1MAPT | |
| Acetic Acid SCHEMBL27311702 | 0.86 | ALDH1A1 (0.55) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL30697786 | 0.86 | PTPRC (0.95) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL30715501 | 0.86 | PTPRC (0.95) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL27880766 | 0.86 | PTPRC (0.95) | PTPRCCES1KDM4EALDH1A1MAPT | |
| 1,2-Naphthoquinone SCHEMBL27864137 | 0.86 | PTPRC (0.95) | PTPRCCES1KDM4EALDH1A1MAPT |
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-1304380-C | Benzo[a]henazin-11-carboxamide derivatives and their use as joint inhibitors of topomerase I and II | XENOVA LTD (GB) | 2007-03-14 | — | — | CN | disclosed |
| CN-1433406-A | Benzo [ a ] phenazine-11-amide derivatives and their use as combined topoisomerase I and II inhibitors | XENOVA LTD (GB) | 2003-07-30 | — | — | CN | disclosed |