Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 4/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL27937782 | 0.98 | TSHR (0.46) | TSHRCYP2A6CYP1A2SLC2A1CNR1 | |
| SCHEMBL12301187 | 0.90 | SLC2A1 (0.47) | TSHRCYP2A6CYP1A2SLC2A1CNR1 | |
| SCHEMBL9485052 | 0.88 | SLC2A1 (0.49) | TSHRCYP2A6CYP1A2SLC2A1CNR1 | |
| SCHEMBL5249927 | 0.85 | CYP2A6 (0.50) | TSHRCYP2A6CYP1A2SLC2A1L3MBTL1 | |
| SCHEMBL2703781 | 0.82 | GAA (0.53) | TSHRCNR1CNR2L3MBTL1GAA | |
| SCHEMBL991491 | 0.81 | KCNH2 (0.48) | TSHRCYP1A2SLC2A1CNR1CNR2 | |
| SCHEMBL18536959 | 0.80 | KDM4E (0.57) | TSHRCYP2A6CYP1A2TDP1ALDH1A1 | |
| SCHEMBL15863499 | 0.80 | CYP1A2 (0.48) | TSHRCYP2A6CYP1A2L3MBTL1GAA | |
| SCHEMBL29371827 | 0.79 | TLR8 (0.44) | TSHRCYP1A2SLC2A1CNR1CNR2 | |
| SCHEMBL7966951 | 0.79 | TLR8 (0.44) | TSHRCYP1A2SLC2A1CNR1CNR2 |
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-0247513-B1 | PROCESS FOR PRODUCING 2-METHYL-1,4-NAPHTHOQUINONE | Eisai Chemical Co., Ltd. (JP) | 1991-09-11 | — | — | EP | disclosed |
| US-4906411-A | Process for producing 2-methyl-1,4-naphthoquinone | EISAI CHEMICAL CO., LTD. (JP) | 1990-03-06 | — | — | US | disclosed |