Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | LDHA | P00338 | 1/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | CFTR | P13569 | 1/20 | 0.46 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KDM4A | O75164 | 1/20 | 0.44 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.41 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12565662 | 0.81 | NPC1 (0.57) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL10726702 | 0.81 | TSHR (0.62) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL8773458 | 0.80 | HCRTR1 (0.62) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL11103392 | 0.80 | TSHR (0.63) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL28716635 | 0.79 | ALDH1A1 (0.61) | KDM4ENPC1RAB9ALMNAPOLB | |
| SCHEMBL10534850 | 0.79 | TDP1 (0.59) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL11162266 | 0.78 | TSHR (0.64) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL21253906 | 0.78 | KMT2A (0.52) | KMT2AKDM4EATMNPC1RAB9A | |
| SCHEMBL9649879 | 0.77 | TDP1 (0.65) | KMT2ANPC1RAB9ALMNAHTT | |
| SCHEMBL10718315 | 0.76 | CYP3A4 (0.61) | KMT2AKDM4EATMNPC1RAB9A |
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-116410949-A | Madder 1, 4-dihydroxy-2-naphthoic acid isopentenyl transferase and encoding gene and application thereof | 中国中医科学院中药研究所 | 2023-07-11 | — | — | CN | disclosed |