Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | CASP3 | P42574 | 1/20 | 0.55 |
| ▸ | MMP13 | P45452 | 1/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28083799 | 0.85 | CASP3 (0.57) | KMT2AMEN1CASP3ALDH1A1KDM4E | |
| SCHEMBL1638641 | 0.84 | CASP3 (0.57) | KMT2AHPGDCASP3HDAC1HDAC7 | |
| SCHEMBL17146225 | 0.83 | KMT2A (0.56) | KMT2AMEN1HPGDCASP3NPSR1 | |
| SCHEMBL20806115 | 0.82 | KDM4E (0.47) | KMT2AMEN1HPGDCASP3HDAC3 | |
| SCHEMBL17146224 | 0.82 | NPSR1 (0.49) | KMT2AMEN1HPGDCASP3HDAC3 | |
| SCHEMBL16369831 | 0.79 | CA1 (0.61) | KMT2AMEN1HPGDENPP2CA12 | |
| SCHEMBL17946340 | 0.79 | KMT2A (0.67) | KMT2AMEN1HPGDCASP3MMP13 | |
| SCHEMBL20806112 | 0.78 | TDP1 (0.50) | KMT2AMEN1HPGDCASP3ALDH1A1 | |
| SCHEMBL30472950 | 0.78 | CASP3 (0.85) | KMT2AMEN1HPGDCASP3HDAC1 | |
| SCHEMBL326305 | 0.78 | CASP3 (0.85) | KMT2AMEN1HPGDCASP3HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108729025-A | A kind of fluorescent optical sensor and preparation method thereof based on amino modified polystyrene | 齐鲁工业大学 | 2018-11-02 | — | — | CN | disclosed |
| CN-108680543-A | A method of detection nitro arene explosive substance | 齐鲁工业大学 | 2018-10-19 | — | — | CN | disclosed |