Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.31 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.30 |
| ▸ | IKBKB | O14920 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.30 |
| ▸ | ERN1 | O75460 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL18683416 | 0.90 | — | — | |
| SCHEMBL14461263 | 0.87 | KDM4E (0.32) | ALDH1A1CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL13007052 | 0.86 | ACMSD (0.37) | ALDH1A1TP53ACMSDESR1ESR2 | |
| SCHEMBL257176 | 0.86 | ACMSD (0.37) | ALDH1A1TP53ACMSDESR1ESR2 | |
| SCHEMBL22333863 | 0.85 | — | — | |
| SCHEMBL12928339 | 0.85 | GPR84 (0.37) | ALDH1A1TP53ACMSDESR1ESR2 | |
| SCHEMBL8406128 | 0.85 | GPR84 (0.37) | ALDH1A1TP53ACMSDESR1ESR2 | |
| SCHEMBL13007071 | 0.85 | ACMSD (0.36) | ALDH1A1LMNATP53ACMSDESR1 | |
| SCHEMBL12014680 | 0.85 | ACMSD (0.36) | ALDH1A1LMNATP53ACMSDESR1 | |
| SCHEMBL12928333 | 0.83 | ESR1 (0.37) | ALDH1A1TP53ACMSDESR1ESR2 |
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-20130006118-A1 | RADIATIVE FIBERS | MERCK PATENT GMBH (DE) | 2013-01-03 | — | — | US | disclosed |