Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 4/20 | 0.34 |
| ▸ | MMP2 | P08253 | 3/20 | 0.33 |
| ▸ | MMP3 | P08254 | 3/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | CTSG | P08311 | 1/20 | 0.32 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.32 |
| ▸ | CMA1 | P23946 | 1/20 | 0.32 |
| ▸ | CTSL | P07711 | 2/20 | 0.32 |
| ▸ | CTSB | P07858 | 2/20 | 0.32 |
| ▸ | CTSH | P09668 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL679142 | 0.76 | TSHR (0.46) | TSHRALDH1A1TDP1GAAXBP1 | |
| Acetaldehyde SCHEMBL20873390 | 0.69 | ALDH1A1 (0.58) | TSHRALDH1A1TDP1GAAATM | |
| SCHEMBL7198536 | 0.69 | ALDH1A1 (0.53) | TSHRALDH1A1TDP1GAAXBP1 | |
| Hexane SCHEMBL27260332 | 0.68 | ALDH1A1 (0.75) | TSHRALDH1A1TDP1GAAXBP1 | |
| Pentane SCHEMBL27743488 | 0.68 | ALDH1A1 (0.75) | TSHRALDH1A1TDP1GAAXBP1 | |
| SCHEMBL984118 | 0.67 | TSHR (0.42) | TSHRALDH1A1TDP1GAAXBP1 | |
| Heptane SCHEMBL27259929 | 0.67 | ALDH1A1 (0.72) | TSHRALDH1A1TDP1GAAXBP1 | |
| SCHEMBL107936 | 0.66 | TSHR (0.45) | TSHRGAAXBP1ATMNPSR1 | |
| SCHEMBL982114 | 0.66 | TSHR (0.45) | TSHRALDH1A1TDP1GAAXBP1 | |
| SCHEMBL6547258 | 0.65 | TSHR (0.52) | TSHRALDH1A1TDP1ATMMEN1 |
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-4059652-A | PHENOLIC | DART INDUSTRIES INC. (US) | 1977-11-22 | — | — | US | disclosed |