Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHPS | P49366 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 6/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28859520 | 0.83 | AHR (0.43) | HTR1ACYP1A2CYP3A4LMNAADRB2 | |
| Indole SCHEMBL28167600 | 0.72 | TRPA1 (0.55) | MEN1KMT2AKDM4ETSHRSLC6A3 | |
| SCHEMBL27658621 | 0.68 | DHPS (0.52) | DHPSMEN1KMT2ATUBB4ATUBB | |
| SCHEMBL12543813 | 0.66 | HTR1A (0.43) | DHPSHTR1ACYP1A2CYP3A4LMNA | |
| SCHEMBL6102036 | 0.66 | DHPS (0.40) | DHPSHTR1ACYP1A2CYP3A4LMNA | |
| SCHEMBL14185150 | 0.65 | DHPS (0.60) | DHPSMEN1KMT2ATP53MAPK1 | |
| SCHEMBL19730140 | 0.65 | DHPS (0.41) | DHPSHTR1ACYP1A2CYP3A4LMNA | |
| SCHEMBL16720205 | 0.64 | G6PD (0.41) | DHPSKDM4EMAPK1TUBB4ATUBB | |
| SCHEMBL10629655 | 0.63 | MAPT (0.43) | DHPSMEN1KMT2ATP53CTSL | |
| SCHEMBL19216716 | 0.63 | S1PR4 (0.44) | DHPSCYP1A2CYP3A4LMNAMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107973780-A | A kind of substituted alkenes compounds and its preparation method and application | 四川科伦博泰生物医药股份有限公司 | 2018-05-01 | — | — | CN | disclosed |