Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 7/20 | 0.62 |
| ▸ | CYP1B1 | Q16678 | 7/20 | 0.62 |
| ▸ | NQO2 | P16083 | 5/20 | 0.62 |
| ▸ | ESR1 | P03372 | 4/20 | 0.62 |
| ▸ | TTR | P02766 | 4/20 | 0.62 |
| ▸ | AHR | P35869 | 3/20 | 0.62 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.62 |
| ▸ | ABL1 | P00519 | 2/20 | 0.62 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.62 |
| ▸ | BCR | P11274 | 2/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.62 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.62 |
| ▸ | TUBB | P07437 | 2/20 | 0.62 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.62 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.62 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.62 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.62 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL8206185 | 1.00 | CYP1A1 (0.62) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL16168068 | 0.93 | CYP1A1 (0.71) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL16167739 | 0.92 | CYP1A1 (0.61) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL8199129 | 0.91 | PTGS2 (0.67) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL8199126 | 0.91 | PTGS2 (0.67) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL12667489 | 0.89 | CYP1A1 (0.77) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL13984043 | 0.89 | CYP1A1 (0.77) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL7904563 | 0.88 | RELA (0.78) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL10015741 | 0.88 | RELA (0.78) | CYP1A1CYP1B1NQO2ESR1TTR | |
| SCHEMBL1366377 | 0.88 | RELA (0.78) | CYP1A1CYP1B1NQO2ESR1TTR |
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 |
|---|---|---|---|---|---|---|---|
| US-6066757-A | MAY BE INCORPORATED INTO PHOTOCONDUCTING LAYER OF ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR AS CHARGE TRANSPORTING MATERIAL | RICOH COMPANY, LTD. (JP) | 2000-05-23 | — | — | US | disclosed |
| US-5641598-A | HAVING HIGH RESISTANCE TO THERMAL AND MECHANICAL SHOCK | RICOH COMPANY, LTD. (JP) | 1997-06-24 | — | — | US | disclosed |