Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13115670 | 0.86 | KDM4E (0.52) | KDM4EHSD17B10TP53HPGD | |
| SCHEMBL11036003 | 0.74 | TP53 (0.55) | KDM4EHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL13115673 | 0.74 | KDM4E (0.48) | KDM4EHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3585648 | 0.71 | ALDH1A1 (0.48) | KDM4EHSD17B10SMN1; SMN2RAB9ALMNA | |
| SCHEMBL3585647 | 0.70 | ATM (0.43) | KDM4EHSD17B10SMN1; SMN2RAB9ALMNA | |
| SCHEMBL4300707 | 0.70 | NPC1 (0.56) | KDM4EHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL24779602 | 0.67 | ALDH1A1 (0.64) | SMN1; SMN2NPC1RAB9ALMNATSHR | |
| SCHEMBL19023119 | 0.67 | SYK (0.56) | KDM4EHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL14564354 | 0.67 | SYK (0.48) | KDM4EHSD17B10SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21464841 | 0.67 | KDM4E (0.44) | KDM4EHSD17B10SMN1; SMN2NPC1RAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7807704-B2 | Bicyclic, nitrogen-containing compounds modulating CXCR4 and/or CCXCKR2 | CHEMOCENTRYX, INC. (US) | 2010-10-05 | — | — | US | disclosed |
| US-7807704-B2 | Bicyclic, nitrogen-containing compounds modulating CXCR4 and/or CCXCKR2 | CHEMOCENTRYX, INC. (US) | 2010-10-05 | — | — | US | disclosed |