Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MC4R | P32245 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | MC3R | P41968 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26622396 | 0.74 | KMT2A (0.47) | HCAR2 | |
| Hydrochloric Acid SCHEMBL150596 | 0.68 | HDAC8 (0.46) | NPC1RAB9AKDM4ESMN1; SMN2TSHR | |
| SCHEMBL26778976 | 0.68 | — | — | |
| SCHEMBL7860519 | 0.67 | HDAC8 (0.42) | NPC1RAB9ANAPRTSMN1; SMN2TSHR | |
| SCHEMBL25520190 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL1712792 | 0.65 | MAPT (0.38) | NPC1RAB9ASMN1; SMN2CYP2A6LMNA | |
| SCHEMBL29922 | 0.65 | HDAC8 (0.48) | NPC1RAB9AKDM4ESMN1; SMN2TSHR | |
| SCHEMBL15822329 | 0.64 | HDAC8 (0.46) | NPC1RAB9AKDM4ESMN1; SMN2TSHR | |
| Bromide SCHEMBL142435 | 0.64 | HDAC8 (0.46) | NPC1RAB9AKDM4ESMN1; SMN2TSHR | |
| SCHEMBL7850001 | 0.62 | HDAC8 (0.34) | HCAR2SMN1; SMN2 |
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-2001005359-A2 | AGENT FOR COLORING KERATIN FIBERS THAT CONTAINS AT LEAST ONE QUATERNARY HETEROCYCLIC ALDEHYDE OR ONE KETONE | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 2001-01-25 | — | — | WO | claimed |