Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 2/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7378447 | 0.90 | MDM2 (0.35) | MDM2DDR1MEN1KMT2AL3MBTL1 | |
| SCHEMBL7379279 | 0.85 | CNR1 (0.35) | MDM2DDR1ALDH1A1EP300CREBBP | |
| SCHEMBL7379415 | 0.84 | MAPT (0.32) | MDM2DDR1MGLLMEN1KMT2A | |
| SCHEMBL6925564 | 0.76 | EGFR (0.45) | MDM2DDR1KDM4EALDH1A1EP300 | |
| SCHEMBL6924610 | 0.72 | ALDH1A1 (0.61) | MEN1KMT2AALDH1A1EP300CREBBP | |
| SCHEMBL6926419 | 0.72 | MEN1 (0.48) | MDM2MEN1KMT2AL3MBTL1KDM4E | |
| SCHEMBL6923255 | 0.66 | HTR2C (0.46) | MDM2DDR1KDM4EALDH1A1 | |
| SCHEMBL6926479 | 0.64 | F2 (0.60) | MEN1KMT2AALDH1A1EP300CREBBP | |
| SCHEMBL6925575 | 0.64 | EGFR (0.45) | MDM2KDM4EALDH1A1EP300CREBBP | |
| SCHEMBL6919944 | 0.62 | HTRA1 (0.42) | DDR1MEN1KMT2AL3MBTL1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002050056-A1 | BENZYLAMINE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2002-06-27 | — | — | WO | disclosed |