Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL872064 | 0.88 | ALDH1A1 (0.56) | ALDH1A1TSHRCA1CA2ADRA2B | |
| SCHEMBL8747528 | 0.88 | CA2 (0.56) | ALDH1A1TSHRTP53CA1CA2 | |
| Acetic Acid SCHEMBL2127698 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TSHRADRA2BPTGS1TDP1 | |
| SCHEMBL10878354 | 0.80 | CA2 (0.58) | ALDH1A1TSHRTP53CA1CA2 | |
| SCHEMBL3426863 | 0.80 | ALDH1A1 (0.58) | ALDH1A1TSHRCA1CA2ADRA2B | |
| SCHEMBL11771306 | 0.80 | CA2 (0.52) | ALDH1A1TSHRTP53CA1CA2 | |
| SCHEMBL21693960 | 0.80 | ALDH1A1 (0.44) | ALDH1A1TSHRADRA2BPTGS1TDP1 | |
| SCHEMBL19973199 | 0.76 | TSHR (0.52) | ALDH1A1TSHRTP53CA1CA2 | |
| SCHEMBL1369853 | 0.76 | ALDH1A1 (0.52) | ALDH1A1TSHRADRA2BPTGS1TDP1 | |
| SCHEMBL104203 | 0.76 | TP53 (0.56) | ALDH1A1TSHRTP53CA1CA2 |
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-20100167333-A1 | Heavy Metal Binding Compounds and Their Method of Use | Life Technologies Corporation (US) | 2010-07-01 | — | — | US | disclosed |
| US-7521577-B2 | Heavy metal binding compounds and their method of use | MOLECULAR PROBES, INC. (US) | 2009-04-21 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20100167333-A1 | Heavy Metal Binding Compounds and Their Method of Use | SLC30A6, SLC30A5, SLC30A7 | ALDH1A1 1070/4885TSHR 629/4885TP53 1819/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.