Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.32 |
| ▸ | CHRNG | P07510 | 2/20 | 0.32 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRND | Q07001 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16381560 | 0.75 | DRD2 (0.46) | MEN1KMT2AALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL7792229 | 0.75 | CYP2C19 (0.45) | ALDH1A1TDP1KDM4ECHRNA1CHRNG | |
| SCHEMBL10637412 | 0.69 | CHRNA1 (0.33) | KMT2AALDH1A1CHRNA1CHRNGCHRNB1 | |
| SCHEMBL7795756 | 0.67 | CHRNA1 (0.46) | ALDH1A1CYP3A4TSHRKDM4ECHRNA1 | |
| SCHEMBL4856372 | 0.67 | CYP3A4 (0.38) | MEN1KMT2AALDH1A1CYP3A4MAOA | |
| SCHEMBL7796227 | 0.66 | CHRNA1 (0.40) | MEN1KMT2AALDH1A1NPC1CHRNA1 | |
| SCHEMBL6302031 | 0.66 | CHRNA1 (0.50) | MEN1KMT2AKDM4ENPC1CHRNA1 | |
| SCHEMBL21156708 | 0.65 | HTR2A (0.53) | CYP3A4KDM4ENPC1 | |
| SCHEMBL209984 | 0.63 | NPC1 (0.56) | MEN1KMT2AALDH1A1CYP3A4TSHR | |
| SCHEMBL29532421 | 0.63 | NPC1 (0.56) | MEN1KMT2AALDH1A1CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017103615-A1 | COMBINATION PRODUCT | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2017-06-22 | — | — | WO | disclosed |