Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.65 |
| ▸ | GFER | P55789 | 1/20 | 0.65 |
| ▸ | ESR1 | P03372 | 2/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12352175 | 0.82 | ESR2 (0.62) | ALDH1A1HPGDGFERESR1ESR2 | |
| SCHEMBL12352176 | 0.82 | ESR2 (0.62) | ALDH1A1HPGDGFERESR1ESR2 | |
| SCHEMBL12336908 | 0.81 | ESR2 (0.78) | ESR1ESR2MEN1KMT2ANOS1 | |
| SCHEMBL19774411 | 0.81 | ESR2 (0.60) | ALDH1A1HPGDGFERESR1ESR2 | |
| SCHEMBL4450591 | 0.79 | ESR2 (0.74) | ALDH1A1ESR1ESR2MEN1KMT2A | |
| SCHEMBL16234062 | 0.78 | ESR2 (0.57) | ALDH1A1HPGDGFERESR1ESR2 | |
| SCHEMBL16234038 | 0.78 | ESR2 (0.57) | ALDH1A1HPGDGFERESR1ESR2 | |
| SCHEMBL14607909 | 0.78 | ALDH1A1 (0.56) | ALDH1A1HPGDGFERESR1ESR2 | |
| SCHEMBL4403121 | 0.78 | ESR2 (0.68) | ALDH1A1ESR1ESR2RAB9AMEN1 | |
| SCHEMBL8087997 | 0.77 | ALDH1A1 (0.70) | ALDH1A1HPGDGFERMAPK1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| JP-8003127-A | — | — | None | — | — | JP | disclosed |
| JP-H083127-A | PHENYLIMINE AND RECORDING MATERIAL USING THE SAME | YAMADA CHEM CO LTD | 1996-01-09 | — | — | JP | disclosed |