Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL12895154 | 0.82 | NPC1 (0.43) | ESR1ESR2KDM4EALDH1A1RAB9A | |
| SCHEMBL4410741 | 0.82 | THRB (0.53) | ESR1ESR2KDM4EALDH1A1RAB9A | |
| SCHEMBL12895146 | 0.80 | NPC1 (0.54) | ESR2KDM4EALDH1A1RAB9ANPC1 | |
| SCHEMBL11209301 | 0.80 | CA12 (0.53) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL17034385 | 0.78 | RAB9A (0.48) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL12895149 | 0.77 | ESR1 (0.52) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL17034383 | 0.77 | ALDH1A1 (0.53) | ESR1ESR2CA12CA1CA2 | |
| SCHEMBL1898363 | 0.76 | HCAR2 (0.48) | CA12CA1CA6CA9THRB | |
| SCHEMBL7285469 | 0.75 | ESR1 (0.53) | ESR1ESR2CA12CA1CA2 | |
| Potassium SCHEMBL10377714 | 0.73 | ESR1 (0.51) | ESR1ESR2CA12CA1CA2 |
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-20110033804-A1 | PHOTORESIST COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-02-10 | — | — | US | disclosed |
| US-20110033804-A1 | PHOTORESIST COMPOSITION | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-02-10 | — | — | US | disclosed |