Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 12/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.45 |
| ▸ | NPC1 | O15118 | 11/20 | 0.45 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.45 |
| ▸ | GAA | P10253 | 5/20 | 0.45 |
| ▸ | GLA | P06280 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.45 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6741707 | 0.73 | AR (0.42) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| SCHEMBL827403 | 0.71 | RAB9A (0.67) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| SCHEMBL12687385 | 0.70 | CHRM2 (0.47) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| Hydrogen Sulfide SCHEMBL28205214 | 0.69 | RAB9A (0.64) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| Hydrogen Sulfide SCHEMBL16859912 | 0.69 | RAB9A (0.64) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| Methane SCHEMBL28056221 | 0.69 | RAB9A (0.64) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| SCHEMBL3073946 | 0.68 | RAB9A (0.69) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| SCHEMBL6744628 | 0.67 | KDM4E (0.43) | RAB9AKDM4ENPC1MAPTALDH1A1 | |
| SCHEMBL639800 | 0.67 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL639799 | 0.67 | ALDH1A1 (0.32) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20040086983-A1 | Method for producing a heterocyclic compound and an aromatic carboxylic acid having one or more hydroxyl groups, and modified aromatic ring dioxygenase | MARINE BIOTHECHNOLOGY INSTITUTE., LTD. (JP) | 2004-05-06 | — | — | US | disclosed |