Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4637963 | 0.88 | USP2 (0.45) | USP2MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL4637960 | 0.87 | USP2 (0.41) | USP2MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL4637999 | 0.83 | IDH1 (0.46) | MEN1KMT2AAKR1C3SMN1; SMN2CYP1A2 | |
| SCHEMBL4639419 | 0.82 | CYP19A1 (0.41) | USP2MEN1KMT2ACYP2D6AKR1C3 | |
| SCHEMBL4637768 | 0.81 | USP2 (0.37) | USP2MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL4707976 | 0.79 | CYP19A1 (0.57) | MEN1KMT2AAKR1C3TSHRSMN1; SMN2 | |
| SCHEMBL4637872 | 0.79 | USP2 (0.36) | USP2MEN1KMT2ACYP3A4CYP2D6 | |
| SCHEMBL4707138 | 0.78 | IDH1 (0.47) | MEN1KMT2ACYP3A4TSHRSMN1; SMN2 | |
| SCHEMBL6071549 | 0.77 | SMN1; SMN2 (0.64) | MEN1KMT2ACYP2D6AKR1C3TSHR | |
| SCHEMBL4637887 | 0.76 | USP2 (0.36) | USP2MEN1KMT2ACYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |
| EP-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |