Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | BCR | P11274 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.37 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.37 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1644667 | 0.86 | ABL1 (0.41) | ABL1ABCB1BCRCA12CA1 | |
| SCHEMBL17514647 | 0.84 | ABL1 (0.43) | ABL1ABCB1BCRMAPT | |
| SCHEMBL9430886 | 0.80 | CYP1A1 (0.42) | PRKAB2PRKAG1PRKAA2PRKAA1PRKAG3 | |
| SCHEMBL3542668 | 0.80 | ABL1 (0.42) | ABL1ABCB1BCRCA12CA1 | |
| SCHEMBL9268604 | 0.80 | ABL1 (0.42) | ABL1ABCB1BCRCA12CA1 | |
| SCHEMBL5899213 | 0.79 | HPGD (0.35) | PTGS2MAPTKDM4EKMT2APRKAB2 | |
| SCHEMBL435758 | 0.79 | AHR (0.42) | PTGS2KDM4ETP53 | |
| SCHEMBL16719656 | 0.79 | ESR2 (0.47) | ABL1ABCB1BCRCA12CA1 | |
| SCHEMBL6271291 | 0.79 | ABL1 (0.41) | ABL1ABCB1BCRCA12CA1 | |
| SCHEMBL4932466 | 0.79 | MAPT (0.44) | ABL1ABCB1BCRCA12CA1 |
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-5356908-A | Agriculture | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1994-10-18 | — | — | US | disclosed |
| US-5223523-A | Agriculture | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-06-29 | — | — | US | disclosed |
| US-4957933-A | Fungicidal oxazolidinones | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1990-09-18 | — | — | US | disclosed |