Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.53 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL1124610 | 1.00 | P4HTM (0.58) | P4HTMTHRBATMNPC1RAB9A | |
| SCHEMBL1124609 | 1.00 | P4HTM (0.58) | P4HTMTHRBATMNPC1RAB9A | |
| SCHEMBL20139654 | 1.00 | P4HTM (0.58) | P4HTMTHRBATMNPC1RAB9A | |
| SCHEMBL28608967 | 0.88 | F3 (0.56) | NPC1RAB9AKDM4ESMN1; SMN2LMNA | |
| SCHEMBL3728757 | 0.88 | MKNK1 (0.56) | P4HTMTHRBATMNPC1RAB9A | |
| SCHEMBL3728756 | 0.88 | MKNK1 (0.56) | P4HTMTHRBATMNPC1RAB9A | |
| SCHEMBL28609817 | 0.87 | GSK3B (0.60) | THRBNPC1RAB9AKDM4ESMN1; SMN2 | |
| SCHEMBL17339657 | 0.85 | NNMT (0.54) | NPC1RAB9AKDM4ESMN1; SMN2LMNA | |
| SCHEMBL8664417 | 0.85 | FDPS (0.58) | NPC1RAB9AKDM4ESMN1; SMN2LMNA | |
| SCHEMBL8664419 | 0.85 | FDPS (0.58) | NPC1RAB9AKDM4ESMN1; SMN2LMNA |
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-112409360-B | Heteroaryl vinyl xanthine derivatives and uses thereof | 广东东阳光药业有限公司 | 2022-12-23 | — | — | CN | disclosed |