Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12848579 | 0.87 | ALDH1A1 (0.58) | ALDH1A1HSD17B10CYP3A4TDP1TSHR | |
| Hydrochloric Acid SCHEMBL28165224 | 0.85 | ALDH1A1 (0.56) | ALDH1A1HSD17B10CYP3A4TDP1TSHR | |
| SCHEMBL12990227 | 0.77 | CYP19A1 (0.54) | ALDH1A1HSD17B10TDP1HTTAPP | |
| SCHEMBL12990446 | 0.77 | CYP19A1 (0.54) | ALDH1A1HSD17B10TDP1HTTAPP | |
| SCHEMBL13264504 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CYP3A4TDP1TSHR | |
| SCHEMBL28198316 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HSD17B10CYP3A4TDP1TSHR | |
| SCHEMBL11499270 | 0.74 | LMNA (0.59) | CYP3A4TDP1CYP2C9LMNACYP1A2 | |
| SCHEMBL11499268 | 0.74 | LMNA (0.59) | CYP3A4TDP1CYP2C9LMNACYP1A2 | |
| SCHEMBL19391792 | 0.72 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP3A4TDP1TSHR | |
| SCHEMBL13100599 | 0.72 | NFE2L2 (0.52) | ALDH1A1CA1CA2CA9CA12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9249101-B2 | Tau imaging probe | CLINO LTD. (JP) | 2016-02-02 | — | — | US | disclosed |