Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18084402 | 0.71 | APLNR (0.35) | KMT2A | |
| SCHEMBL23118976 | 0.71 | MEN1 (0.33) | ESR1MEN1KMT2A | |
| SCHEMBL27671157 | 0.71 | ESR1 (0.33) | ESR1MEN1KMT2A | |
| SCHEMBL19083690 | 0.69 | ATM (0.36) | ESR1MEN1KMT2A | |
| SCHEMBL26999754 | 0.68 | APLNR (0.34) | ESR1MEN1KMT2A | |
| SCHEMBL27926042 | 0.68 | KMT2A (0.36) | ESR1MEN1KMT2A | |
| SCHEMBL23068014 | 0.68 | ESR1 (0.31) | ESR1MEN1KMT2A | |
| SCHEMBL18084399 | 0.68 | — | — | |
| SCHEMBL26432338 | 0.67 | — | — | |
| SCHEMBL23897224 | 0.67 | TP53 (0.32) | ESR1MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE44186-E1 | Cyclopropyl-fused pyrrolidine-based inhibitors of dipeptidyl peptidase IV and method | BRISTOL-MYERS SQUIBB COMPANY (US) | 2013-04-30 | — | — | US | disclosed |