Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 3/20 | 0.60 |
| ▸ | BCR | P11274 | 3/20 | 0.60 |
| ▸ | POLB | P06746 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28395665 | 0.91 | ABL1 (0.61) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL28396799 | 0.87 | ABL1 (0.55) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL2568434 | 0.87 | POLB (0.57) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL31122514 | 0.86 | POLB (0.58) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL28993060 | 0.85 | ABL1 (0.55) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL28993059 | 0.85 | ABL1 (0.55) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL28392847 | 0.85 | ABL1 (0.55) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL28733147 | 0.85 | ABL1 (0.55) | ABL1BCRPOLBCYP1A2CYP3A4 | |
| SCHEMBL29639985 | 0.83 | NPC1 (0.63) | ABL1BCRCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL7722205 | 0.80 | NPC1 (0.62) | POLBCYP1A2CYP3A4CYP2C19KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109761957-B | Hydroxyproline-containing compound and preparation method and application thereof | 西安交通大学 | 2020-05-19 | — | — | CN | claimed |
| CN-109796439-B | Hydroxyproline peptide derivative and preparation method and application thereof | 西安交通大学 | 2020-05-19 | — | — | CN | claimed |
| CN-109796439-B | Hydroxyproline peptide derivative and preparation method and application thereof | 西安交通大学 | 2020-05-19 | — | — | CN | disclosed |
| CN-109761957-B | Hydroxyproline-containing compound and preparation method and application thereof | 西安交通大学 | 2020-05-19 | — | — | CN | disclosed |