Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9363954 | 0.79 | NFE2L2 (0.39) | TSHRTDP1MAPTTP53KMT2A | |
| SCHEMBL3356087 | 0.79 | ALOX5 (0.36) | TSHRSMN1; SMN2CA1CA2CA9 | |
| SCHEMBL100407 | 0.78 | LTA4H (0.41) | TSHRRELALTA4HTP53 | |
| 1,4-Diethoxybenzene SCHEMBL28186701 | 0.76 | NQO1 (1.00) | NQO1TSHRTDP1RELALTA4H | |
| 1,4-Diethoxybenzene SCHEMBL124015 | 0.76 | NQO1 (1.00) | NQO1TSHRTDP1RELALTA4H | |
| SCHEMBL23581930 | 0.76 | CHRNB2 (0.41) | RELALTA4HALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL2096167 | 0.74 | NQO1 (0.64) | NQO1TSHRTDP1RELALTA4H | |
| SCHEMBL11518638 | 0.74 | NQO1 (0.64) | NQO1TSHRTDP1RELALTA4H | |
| 1,4-Diethoxybenzene SCHEMBL11794798 | 0.74 | NQO1 (0.93) | NQO1TSHRTDP1RELALTA4H | |
| SCHEMBL9379266 | 0.73 | TP53 (0.51) | TSHRALDH1A1CA1CA2TP53 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5447900-A | Fluoran leuco dye and developer | RICOH COMPANY, LTD. (JP) | 1995-09-05 | — | — | US | disclosed |