Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4623560 | 0.71 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL29442976 | 0.71 | ALDH1A1 (0.44) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL27483792 | 0.70 | HSD17B10 (0.39) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| Lithium SCHEMBL29767624 | 0.69 | ALDH1A1 (0.42) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL51496 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL29490374 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL5503788 | 0.68 | ALDH1A1 (0.41) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL1505694 | 0.67 | ANPEP (0.41) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| Charcoal, Activated SCHEMBL30949786 | 0.67 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 | |
| SCHEMBL30642055 | 0.67 | ALDH1A1 (0.39) | ALDH1A1HSD17B10TSHRCYP2A6TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1036077-B1 | PHOTOCHROMIC PYRANO-FUSED NAPHTHOPYRANS | TRANSITIONS OPTICAL INC (US) | 2004-02-04 | — | — | EP | disclosed |
| US-6106744-A | HAVING A SUBSTITUTED OR UNSUBSTITUTED ?S? PYRAN RING, THE 3,4 POSITIONS OF WHICH ARE FUSED TO THE F SIDE OF THE NAPHTHO PORTION OF THE NAPHTHOPYRAN, AND CERTAIN SUBSTITUENTS AT THE 2-POSITION OF THE ?T? PYRAN RING. | PPG INDUSTRIES OHIO, INC. (US) | 2000-08-22 | — | — | US | disclosed |