Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL79324 | 0.83 | ALDH1A1 (0.44) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL8414130 | 0.76 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL30209191 | 0.76 | ALDH1A1 (0.52) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL10340797 | 0.76 | ESR1 (0.54) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL2548283 | 0.75 | CA12 (0.58) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL18579826 | 0.75 | ESR1 (0.42) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL28532235 | 0.75 | ALDH1A1 (0.41) | ALDH1A1CYP3A4CA12CA2CA9 | |
| Resorcinol SCHEMBL28043577 | 0.75 | ALDH1A1 (0.75) | ALDH1A1CYP3A4CA12CA2CA9 | |
| Resorcinol SCHEMBL27604834 | 0.75 | ALDH1A1 (0.75) | ALDH1A1CYP3A4CA12CA2CA9 | |
| SCHEMBL12879274 | 0.74 | ACHE (0.50) | ALDH1A1CYP3A4ACHECYP2C9TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5359065-A | Reacting a bromo aromatic compound with an excess of silylating agent; forming metallized intermediate; quenching | EASTMAN KODAK COMPANY (US) | 1994-10-25 | — | — | US | disclosed |
| EP-0601642-A1 | Photographic silver halide material and process | EASTMAN KODAK COMPANY (US) | 1994-06-15 | — | — | EP | disclosed |
| US-5306604-A | Dispersibility, low melting points | EASTMAN KODAK COMPANY (US) | 1994-04-26 | — | — | US | disclosed |