Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 6/20 | 0.65 |
| ▸ | CDK1 | P06493 | 2/20 | 0.65 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.63 |
| ▸ | TNIK | Q9UKE5 | 6/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | STAT1 | P42224 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | GAK | O14976 | 1/20 | 0.48 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | KIT | P10721 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL18434151 | 0.89 | CHEK1 (0.67) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL21262377 | 0.84 | TNIK (0.83) | CDK2CDK1CHEK1TNIKGAK | |
| SCHEMBL21262705 | 0.82 | TNIK (0.66) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL21262430 | 0.82 | CDK2 (0.67) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL12524973 | 0.81 | CHEK1 (0.62) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL21262648 | 0.79 | TNIK (0.85) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL9820222 | 0.78 | TNIK (0.85) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL6241589 | 0.77 | CHEK1 (1.00) | CDK2CDK1CHEK1TNIK | |
| SCHEMBL21247715 | 0.76 | CDK2 (0.76) | CDK2CDK1CHEK1TNIKALDH1A1 | |
| SCHEMBL21247516 | 0.76 | TNIK (1.00) | CDK1CHEK1TNIKGAKPDGFRB |
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-20050043381-A1 | Aminopyrazole compounds | AGOURON PHARMACEUTICALS, INC. | 2005-02-24 | — | — | US | disclosed |
| WO-2005009435-A1 | AMINOPYRAZOLE COMPOUNDS AND USE AS CHK1 INHIBITORS | PFIZER INC. (US) | 2005-02-03 | — | — | WO | 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-20050043381-A1 | Aminopyrazole compounds | CDK1, CDK3, BUB1B | CDK2 11/4885CDK1 1/4885CHEK1 4/4885 |
“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.