Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | NT5E | P21589 | 2/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.36 |
| ▸ | NOS1 | P29475 | 1/20 | 0.36 |
| ▸ | NOS2 | P35228 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9099242 | 1.00 | HSP90AA1 (0.46) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL9098055 | 0.91 | HSP90AA1 (0.54) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL9097312 | 0.84 | HSP90AA1 (0.65) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL9097323 | 0.84 | HSP90AA1 (0.65) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL9100934 | 0.80 | HSP90AA1 (0.52) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL9099567 | 0.80 | SCN9A (0.38) | ALDH1A1CYP2C19HSD11B1CYP3A4L3MBTL1 | |
| SCHEMBL18952921 | 0.77 | CHRNB4 (0.50) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL20576027 | 0.77 | HSP90AA1 (0.43) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL20576024 | 0.77 | HSP90AA1 (0.43) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 | |
| SCHEMBL18952923 | 0.77 | CHRNB4 (0.50) | HSP90AA1NT5ECHRNB4CHRNA3ALDH1A1 |
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-5489501-A | MIXTURES OF TWO COORDINATION COMPOUNDS WHICH REACT TO FORM NEW COORDINATION COMPOUND WHILE CAUSING VISIBLE COLOR CHANGES | RICOH COMPANY, LTD. (JP) | 1996-02-06 | — | — | US | disclosed |
| US-5446011-A | Imagewise coloring when heating; mixture of n-substituted indole, aromatic polyhydroxy compound, carbonyl compound and an acid | RICOH COMPANY, LTD. (JP) | 1995-08-29 | — | — | US | disclosed |