Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3560128 | 0.88 | MTNR1A (0.59) | MTNR1AALDH1A1HPGDCYP3A4MAPK1 | |
| SCHEMBL28683409 | 0.79 | ALDH1A1 (0.41) | ALDH1A1MAPTKDM4EHSD17B10NPC1 | |
| SCHEMBL4222752 | 0.79 | AKR1C3 (0.56) | MTNR1AMAPTKDM4EHSD17B10AKR1C3 | |
| SCHEMBL28696581 | 0.78 | IDO1 (0.37) | ALDH1A1HPGDKDM4EHSD17B10NOTUM | |
| SCHEMBL3554094 | 0.78 | KMT2A (0.42) | MAPTKDM4ENPC1RAB9ANOTUM | |
| SCHEMBL12568301 | 0.77 | AKR1C3 (0.57) | MTNR1AALDH1A1HPGDKDM4EAKR1C3 | |
| SCHEMBL2005467 | 0.77 | PTGS2 (0.46) | MTNR1AKDM4ECYP1A2AKR1C3AKR1C2 | |
| SCHEMBL27998896 | 0.77 | MTNR1A (0.57) | MTNR1AALDH1A1HPGDCYP3A4MAPK1 | |
| SCHEMBL25624246 | 0.76 | MTNR1A (0.65) | MTNR1A | |
| SCHEMBL30394848 | 0.75 | MTNR1A (0.55) | MTNR1AALDH1A1HPGDKDM4EHSD17B10 |
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-114057625-B | C2-acyloxy-3-indolinone derivative and preparation method and application thereof | 五邑大学 | 2023-11-24 | — | — | CN | disclosed |
| CN-114057625-A | C2-acyloxy-3-indolinone derivative and preparation method and application thereof | 五邑大学 | 2022-02-18 | — | — | CN | disclosed |