Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ELANE | P08246 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11826311 | 0.84 | NR1H2 (0.52) | L3MBTL1ALDH1A1GLATSHRNR1H2 | |
| SCHEMBL28218016 | 0.80 | ALDH1A1 (0.49) | TDP1ATML3MBTL1ALDH1A1GLA | |
| SCHEMBL3343171 | 0.80 | ALDH1A1 (0.50) | ALDH1A1GLATSHRNR1H2NR1H3 | |
| SCHEMBL3343176 | 0.80 | ALDH1A1 (0.50) | ALDH1A1GLATSHRNR1H2NR1H3 | |
| SCHEMBL11671701 | 0.79 | TDP1 (0.42) | TDP1ATML3MBTL1ALDH1A1GLA | |
| Hydrochloric Acid SCHEMBL8940097 | 0.78 | ALDH1A1 (0.48) | ALDH1A1GLATSHRNR1H2NR1H3 | |
| Hydrochloric Acid SCHEMBL11671225 | 0.78 | TDP1 (0.41) | TDP1ATML3MBTL1ALDH1A1GLA | |
| SCHEMBL4667661 | 0.77 | ALDH1A1 (0.47) | ALDH1A1GLATSHRNR1H2NR1H3 | |
| SCHEMBL2231429 | 0.76 | ATM (0.50) | TDP1ATML3MBTL1ELANEALDH1A1 | |
| SCHEMBL2777609 | 0.76 | ELANE (0.50) | TDP1ATML3MBTL1ELANEALDH1A1 |
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-4101541-A | DYES FOR POLYESTERS OR POLYPROPYLENE | CIBA-GEIGY CORPORATION (US) | 1978-07-18 | — | — | US | disclosed |