Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 2/20 | 0.65 |
| ▸ | CA1 | P00915 | 1/20 | 0.60 |
| ▸ | CA2 | P00918 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 7/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.60 |
| ▸ | NPC1 | O15118 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | RAB9A | P51151 | 3/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.60 |
| ▸ | RELA | Q04206 | 1/20 | 0.60 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.59 |
| ▸ | TUBB | P07437 | 1/20 | 0.59 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.59 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.59 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.59 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.59 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.59 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL6806549 | 1.00 | NQO2 (0.65) | NQO2CA1CA2MAPTKDM4E | |
| SCHEMBL6806552 | 1.00 | NQO2 (0.65) | NQO2CA1CA2MAPTKDM4E | |
| SCHEMBL13485342 | 0.93 | ALDH1A1 (0.67) | NQO2CA1CA2MAPTKDM4E | |
| SCHEMBL10413988 | 0.93 | ALDH1A1 (0.67) | NQO2CA1CA2MAPTKDM4E | |
| SCHEMBL6801712 | 0.89 | NQO2 (0.79) | NQO2MAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL9862507 | 0.89 | NQO2 (0.79) | NQO2MAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL847532 | 0.89 | NQO2 (0.79) | NQO2MAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL6801718 | 0.89 | NQO2 (0.79) | NQO2MAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL847533 | 0.89 | NQO2 (0.79) | NQO2MAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL847531 | 0.89 | NQO2 (0.79) | NQO2MAPTKDM4ENPC1ALDH1A1 |
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-6762205-B1 | STEROID SULFATASE INHIBITORS WITHOUT ESTROGENIC SIDE EFFECT ACTION | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 2004-07-13 | — | — | US | disclosed |