Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 2/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 5/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 4/20 | 0.35 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | GPR39 | O43194 | 2/20 | 0.33 |
| ▸ | MPO | P05164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL13683095 | 0.84 | CA1 (0.38) | ADORA1METAP1KLKB1RETMPO | |
| SCHEMBL16200168 | 0.83 | METAP1 (0.38) | METAP1METAP2OPRL1PDCD1CD274 | |
| SCHEMBL14044093 | 0.82 | METAP1 (0.36) | ADORA1METAP1METAP2OPRL1RET | |
| SCHEMBL14043989 | 0.77 | ADORA1 (0.44) | ADORA1METAP1METAP2KLKB1RET | |
| SCHEMBL13683032 | 0.76 | SLC2A1 (0.42) | METAP2KDM4ELMNAMEN1NPC1 | |
| SCHEMBL14044137 | 0.67 | ALDH1A1 (0.32) | MPOPOLB | |
| SCHEMBL13683059 | 0.67 | ADORA1 (0.40) | ADORA1METAP1METAP2KLKB1RET | |
| SCHEMBL16200177 | 0.66 | CA1 (0.43) | METAP1KDM4ELMNACYP1A2POLB | |
| SCHEMBL15048580 | 0.63 | KDM4E (0.45) | ADORA1METAP1RETKDM4ELMNA | |
| SCHEMBL13184354 | 0.62 | KDM4E (0.43) | ADORA1METAP1METAP2KDM4ELMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7589199-B2 | Substituted piperazines | CHEMOCENTRYX, INC. (US) | 2009-09-15 | — | — | US | disclosed |
| US-7435831-B2 | Bicyclic and bridged nitrogen heterocycles | CHEMOCENTRYX, INC. (US) | 2008-10-14 | — | — | US | disclosed |
| US-7435830-B2 | Bicyclic and bridged nitrogen heterocycles | CHEMOCENTRYX, INC. (US) | 2008-10-14 | — | — | US | disclosed |