Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | KDR | P35968 | 6/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5354824 | 0.88 | KDR (0.56) | TSHRNPSR1POLBKDRCHEK1 | |
| SCHEMBL5368202 | 0.86 | KDR (0.53) | TSHRNPSR1POLBKDRCHEK1 | |
| SCHEMBL5355164 | 0.76 | VCP (0.41) | TSHRKDRCHEK1PKMKDM4E | |
| SCHEMBL5357812 | 0.72 | KDR (0.49) | KDRCHEK1KDM4E | |
| SCHEMBL5367618 | 0.71 | CDK1 (0.47) | TSHRNPSR1POLBKDRMAPT | |
| SCHEMBL14590420 | 0.69 | CDK1 (0.45) | TSHRNPSR1POLBKDRMAPT | |
| SCHEMBL5363140 | 0.69 | KDR (0.63) | POLBKDRCHEK1KDM4E | |
| SCHEMBL5371286 | 0.67 | KDR (0.79) | TSHRPOLBKDRHRH4HRH3 | |
| SCHEMBL5355081 | 0.67 | KDR (0.56) | POLBKDRCHEK1TP53KDM4E | |
| SCHEMBL29141944 | 0.67 | TPSAB1 (0.61) | TSHRNPSR1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7169788-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2007-01-30 | — | — | US | disclosed |
| US-7169788-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2007-01-30 | — | — | US | disclosed |
| US-7169788-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2007-01-30 | — | — | US | disclosed |