Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.67 |
| ▸ | CA12 | O43570 | 1/20 | 0.65 |
| ▸ | CA1 | P00915 | 1/20 | 0.65 |
| ▸ | CA2 | P00918 | 1/20 | 0.65 |
| ▸ | CA9 | Q16790 | 1/20 | 0.65 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.61 |
| ▸ | HEXA | P06865 | 3/20 | 0.61 |
| ▸ | HEXB | P07686 | 3/20 | 0.61 |
| ▸ | UBE2N | P61088 | 3/20 | 0.58 |
| ▸ | ATM | Q13315 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL5594225 | 0.85 | NPSR1 (1.00) | NPSR1KDM4ECA12CA1CA2 | |
| SCHEMBL3240007 | 0.84 | CASP3 (0.62) | NPSR1CA12CA1CA2CA9 | |
| SCHEMBL30393936 | 0.84 | CASP3 (0.62) | NPSR1CA12CA1CA2CA9 | |
| SCHEMBL28737144 | 0.84 | UBE2N (0.81) | NPSR1KDM4ECA12CA1CA2 | |
| SCHEMBL12793010 | 0.80 | NPSR1 (0.68) | NPSR1KDM4ECA12CA1CA2 | |
| SCHEMBL29226176 | 0.80 | KDM4E (1.00) | NPSR1KDM4ECA12CA1CA2 | |
| SCHEMBL28277899 | 0.80 | CYP1B1 (0.67) | NPSR1KDM4ECA12CA1CA2 | |
| SCHEMBL28626364 | 0.80 | CYP1B1 (0.78) | CYP1B1LMNAALDH1A1MAPTMEN1 | |
| SCHEMBL11678307 | 0.79 | HEXA (0.73) | NPSR1KDM4ECYP1B1HEXAHEXB | |
| SCHEMBL10350199 | 0.77 | NPSR1 (0.62) | NPSR1KDM4ECA12CA1CA2 |
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-109400609-A | SNAP-tag protein tag fluorescence probe with special Fast Labeling ability | 中国科学院大连化学物理研究所 | 2019-03-01 | — | — | CN | claimed |
| CN-109400609-A | SNAP-tag protein tag fluorescence probe with special Fast Labeling ability | 中国科学院大连化学物理研究所 | 2019-03-01 | — | — | CN | disclosed |