Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRMT5 | O14744 | 1/20 | 0.44 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.44 |
| ▸ | CTSC | P53634 | 8/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | EED | O75530 | 3/20 | 0.37 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5809712 | 1.00 | PRMT5 (0.44) | PRMT5WDR77CTSCP2RX7EED | |
| SCHEMBL5093640 | 0.79 | DRD2 (0.32) | — | |
| SCHEMBL927570 | 0.72 | TAAR1 (0.55) | PRMT5WDR77ALDH1A1MEN1LMNA | |
| SCHEMBL5100380 | 0.71 | HDAC1 (0.47) | PRMT5WDR77CTSCP2RX7ALDH1A1 | |
| SCHEMBL5093772 | 0.69 | PRMT5 (0.42) | PRMT5WDR77CTSCMEN1LMNA | |
| Hydrochloric Acid SCHEMBL17025732 | 0.69 | P2RX7 (0.49) | PRMT5WDR77P2RX7 | |
| SCHEMBL10765164 | 0.68 | EED (0.63) | PRMT5WDR77CTSCEEDALDH1A1 | |
| SCHEMBL18967816 | 0.68 | P2RX7 (0.50) | PRMT5WDR77P2RX7 | |
| SCHEMBL17023344 | 0.68 | P2RX7 (0.50) | PRMT5WDR77P2RX7 | |
| SCHEMBL18953172 | 0.68 | P2RX7 (0.50) | PRMT5WDR77P2RX7 |
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-7417062-B2 | e.g. N (S)-(1-Cyclohexylmethyl-pyrrolidine-2-ylmethyl)-3,4-dimethoxy-N-naphthalen-2-ylmethyl-benzamide; inhibit the binding of the SDF-1 (CXCL12) chemokine or I-TAC (CXCL11) to the chemokine receptor CCXCKR2; anticarcinogenic agent; breast, lymph nodes, bone marrow, and lungs cancer | CHEMOCENTRYX, INC. (US) | 2008-08-26 | — | — | US | claimed |