Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
| ▸ | ANPEP | P15144 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL37123 | 0.94 | TSHR (0.40) | TSHRLMNAALDH1A1TDP1THRB | |
| Water SCHEMBL28850770 | 0.90 | TSHR (0.38) | TSHRLMNAALDH1A1TDP1THRB | |
| Hydrochloric Acid SCHEMBL28304571 | 0.90 | TSHR (0.38) | TSHRLMNAALDH1A1TDP1THRB | |
| Bromide SCHEMBL9580196 | 0.88 | TSHR (0.35) | TSHRLMNAALDH1A1TDP1THRB | |
| SCHEMBL11802788 | 0.88 | TSHR (0.35) | TSHRLMNAALDH1A1TDP1THRB | |
| SCHEMBL18528455 | 0.88 | TSHR (0.35) | TSHRLMNAALDH1A1TDP1THRB | |
| Butyl Alcohol SCHEMBL5957146 | 0.86 | ALDH1A1 (0.58) | TSHRLMNAALDH1A1TDP1THRB | |
| Cyclohexane SCHEMBL9235145 | 0.85 | CYP1A2 (0.35) | TSHRLMNAALDH1A1TDP1THRB | |
| SCHEMBL9641770 | 0.84 | TSHR (0.44) | TSHRLMNAALDH1A1TDP1THRB | |
| SCHEMBL10865000 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-105679941-A | P-type delafossite structure semiconductor material-based plane structure perovskite solar cell and preparation thereof | 杭州众能光电科技有限公司 | 2016-06-15 | — | — | CN | disclosed |