Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CCR1 | P32246 | 2/20 | 0.43 |
| ▸ | CCR5 | P51681 | 2/20 | 0.43 |
| ▸ | CCR8 | P51685 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | METAP1 | P53582 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.43 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | TP53 | P04637 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8121980 | 0.79 | ESR1 (0.49) | LRRK2KDM4ELMNAHIF1ACYP1A2 | |
| SCHEMBL29652541 | 0.79 | ESR1 (0.49) | LRRK2KDM4ELMNAHIF1ACYP1A2 | |
| SCHEMBL7892229 | 0.74 | KDM4E (0.38) | KDM4ELMNAHIF1ACYP1A2CCR1 | |
| SCHEMBL7892961 | 0.74 | NPSR1 (0.48) | KDM4ELMNACYP1A2NPC1TP53 | |
| SCHEMBL14833490 | 0.72 | TP53 (0.41) | LRRK2KDM4ELMNAHIF1ACYP1A2 | |
| SCHEMBL6271963 | 0.69 | NPSR1 (0.48) | KDM4ELMNACYP1A2NPC1ALDH1A1 | |
| SCHEMBL24656022 | 0.68 | NPC1 (0.49) | KDM4ELMNAHIF1ACYP1A2CCR1 | |
| Triphenylene SCHEMBL29177844 | 0.68 | KDM4E (0.82) | LRRK2KDM4ELMNAHIF1ACYP1A2 | |
| SCHEMBL17008146 | 0.66 | KDM4E (0.68) | LRRK2KDM4ELMNAHIF1ACYP1A2 | |
| SCHEMBL323086 | 0.66 | KDM4E (0.68) | LRRK2KDM4ELMNAHIF1ACYP1A2 |
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-6180629-B1 | INDUCING OR PROMOTING APOPTOSIS AND FOR ARRESTING UNCONTROLLED NEOPLASTIC CELL PROLIFERATION, INCLUDING PRECANCEROUS AND CANCEROUS LESIONS | CELL PATHWAYS, INC. | 2001-01-30 | — | — | US | disclosed |