Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | WNT1 | P04628 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3599501 | 0.94 | GPR35 (0.38) | HPGDGAATSHRKMT2ATP53 | |
| SCHEMBL3603676 | 0.92 | MTNR1A (0.40) | HPGDGAATSHRKMT2ATP53 | |
| SCHEMBL3602466 | 0.83 | KDM4E (0.44) | HPGDGAATSHRKMT2ATP53 | |
| SCHEMBL3591923 | 0.82 | GRIN2B (0.44) | HPGDGAATSHRKMT2AKDM4E | |
| SCHEMBL3586854 | 0.82 | KDM4E (0.42) | HPGDGAATSHRKMT2AKDM4E | |
| SCHEMBL3596255 | 0.81 | NPC1 (0.46) | KMT2ATP53MAPT | |
| SCHEMBL3586995 | 0.81 | KMT2A (0.47) | KMT2A | |
| SCHEMBL13115590 | 0.78 | ATM (0.47) | ATM | |
| SCHEMBL3609348 | 0.77 | NPC1 (0.40) | TSHRKDM4EMAPK1F10ALDH1A1 | |
| SCHEMBL3604144 | 0.77 | ALDH1A1 (0.43) | HPGDGAATSHRKMT2ATP53 |
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-7807704-B2 | Bicyclic, nitrogen-containing compounds modulating CXCR4 and/or CCXCKR2 | CHEMOCENTRYX, INC. (US) | 2010-10-05 | — | — | US | disclosed |