Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 7/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 7/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 6/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8330411 | 0.94 | ALDH1A1 (0.38) | CASP1ALDH1A1GAANPSR1TSHR | |
| SCHEMBL11023958 | 0.84 | ALDH1A1 (0.36) | ALDH1A1GAANPSR1TSHRCHRM2 | |
| SCHEMBL28558937 | 0.80 | NAAA (0.40) | ALDH1A1GAANPSR1TSHRMEN1 | |
| SCHEMBL28570853 | 0.79 | NAAA (0.42) | ALDH1A1GAANPSR1TSHR | |
| SCHEMBL8330842 | 0.78 | CYP1A2 (0.35) | ALDH1A1CHRM2CHRM1KCNH2CHRM4 | |
| SCHEMBL7141175 | 0.77 | ALDH1A1 (0.38) | ALDH1A1GAATSHRCHRM2CHRM1 | |
| SCHEMBL16732009 | 0.77 | KEAP1 (0.36) | ALDH1A1CHRM2CHRM1KCNH2CYP1A2 | |
| SCHEMBL28564478 | 0.76 | CHRM2 (0.39) | CASP1ALDH1A1GAANPSR1TSHR | |
| SCHEMBL28194306 | 0.76 | TSHR (0.39) | CASP1ALDH1A1GAANPSR1TSHR | |
| SCHEMBL28290403 | 0.75 | ALDH1A1 (0.40) | CASP1ALDH1A1GAANPSR1TSHR |
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-5908863-A | ANTIGROWTH AGENT FOR BONES | DOMPE' S.P.A. (IT) | 1999-06-01 | — | — | US | disclosed |
| EP-0792878-A2 | Geminal carboxylic acids and esters thereof, pharmaceutical formulations containing them useful in the treatment of bone dysmetabolism | Dompé S.P.A. (IT) | 1997-09-03 | — | — | EP | disclosed |