Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 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 | |
|---|---|---|---|---|
| SCHEMBL19514697 | 0.84 | ALDH1A1 (0.45) | MEN1KMT2ACTSSCTSKALDH1A1 | |
| SCHEMBL19514723 | 0.84 | ALDH1A1 (0.45) | MEN1KMT2ACTSSCTSKALDH1A1 | |
| SCHEMBL38121 | 0.80 | PPARA (0.42) | ALDH1A1HPGDLMNAMAPTRAB9A | |
| SCHEMBL38122 | 0.80 | PPARA (0.42) | ALDH1A1HPGDLMNAMAPTRAB9A | |
| SCHEMBL28312030 | 0.78 | RAB9A (0.45) | MEN1KMT2ACTSSCTSKALDH1A1 | |
| SCHEMBL6672462 | 0.77 | MEN1 (0.55) | MEN1KMT2APSMB5ALDH1A1CYP1A2 | |
| SCHEMBL6672463 | 0.77 | MEN1 (0.55) | MEN1KMT2APSMB5ALDH1A1CYP1A2 | |
| SCHEMBL9740320 | 0.76 | CTSS (0.51) | CTSSCTSKALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL7268268 | 0.76 | ANPEP (0.60) | MEN1KMT2APSMB5ALDH1A1CYP1A2 | |
| SCHEMBL6105902 | 0.76 | ANPEP (0.60) | MEN1KMT2APSMB5ALDH1A1CYP1A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113105524-B | Polypeptide derivative copper complex, preparation method and application thereof, and anticancer drug | 首都医科大学 | 2022-05-17 | — | — | CN | disclosed |
| CN-112691081-B | Paclitaxel micelle based on (S) -2-decanoylamino-3- (1-naphthyl) propionyl-leucyl-valine | 首都医科大学 | 2022-04-22 | — | — | CN | disclosed |
| CN-113105524-A | Polypeptide derivative copper complex, preparation method and application thereof, and anticancer drug | 首都医科大学 | 2021-07-13 | — | — | CN | disclosed |
| CN-112691081-A | Paclitaxel micelle based on (S) -2-decanoylamino-3- (1-naphthyl) propionyl-leucyl-valine | 首都医科大学 | 2021-04-23 | — | — | CN | disclosed |
| CN-112279887-A | Amino acid derivative, preparation method and application thereof, anti-tumor micelle and preparation method thereof | 首都医科大学 | 2021-01-29 | — | — | CN | disclosed |