Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.43 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29919659 | 0.82 | CYP2A6 (0.47) | ALDH1A1GLACYP2A6MAPTNPSR1 | |
| SCHEMBL29102436 | 0.82 | CYP2A6 (0.47) | ALDH1A1GLACYP2A6MAPTNPSR1 | |
| SCHEMBL29862266 | 0.81 | CYP2A6 (0.46) | ALDH1A1CYP2A6MAPTNPSR1 | |
| SCHEMBL2314941 | 0.78 | ALDH1A1 (0.47) | ALDH1A1CYP2A6CYP1A2MAPTNPSR1 | |
| SCHEMBL11152052 | 0.74 | ADORA3 (0.61) | RXFP1LMNAHSD17B10KDM4EALDH1A1 | |
| SCHEMBL8956192 | 0.73 | ALOX5 (0.44) | ARALDH1A1MAPK1CYP2A6CYP1A2 | |
| SCHEMBL5451 | 0.73 | SMN1; SMN2 (0.51) | ARLMNAHSD17B10KDM4EALDH1A1 | |
| SCHEMBL30283197 | 0.73 | SMN1; SMN2 (0.51) | ARLMNAHSD17B10KDM4EALDH1A1 | |
| SCHEMBL27875797 | 0.73 | MAPT (0.42) | LMNAALDH1A1CYP2A6S1PR1MAPT | |
| SCHEMBL29102428 | 0.73 | PDE3A (0.38) | PIP4K2ACTSSLMNAHSD17B10KDM4E |
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-5763601-A | SOLUBILITY, PURITY | Shirai, Hirofusa (JP) | 1998-06-09 | — | — | US | disclosed |
| US-5633370-A | Naphthalocyanine compounds, naphthalocyanine polymers and method for making | Shirai, Hirofusa (JP) | 1997-05-27 | — | — | US | disclosed |