Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | METAP1 | P53582 | 7/20 | 0.40 |
| ▸ | METAP2 | P50579 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CCR1 | P32246 | 2/20 | 0.38 |
| ▸ | CCR5 | P51681 | 2/20 | 0.38 |
| ▸ | CCR8 | P51685 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.38 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13162715 | 0.82 | ALDH1A1 (0.44) | ADORA2AADORA1CYP1A2SMN1; SMN2ALOX15 | |
| SCHEMBL13683182 | 0.82 | ADORA2A (0.49) | ADORA2AADORA1KDM4ENPC1HTR2C | |
| SCHEMBL13184431 | 0.82 | CCR1 (0.47) | ADORA2AADORA1KDM4EMETAP2LMNA | |
| SCHEMBL13184346 | 0.81 | KDM4E (0.35) | ADORA2AADORA1KDM4EHTR2CLMNA | |
| SCHEMBL13430363 | 0.80 | KDM4E (0.45) | KDM4ENPC1METAP1METAP2NPSR1 | |
| SCHEMBL13184414 | 0.79 | CCR1 (0.44) | ADORA2AADORA1KDM4EMETAP2LMNA | |
| SCHEMBL13184432 | 0.73 | NOTUM (0.45) | KDM4EMETAP1CYP1A2POLBSMN1; SMN2 | |
| SCHEMBL10330278 | 0.72 | KDM4E (0.48) | ADORA2AADORA1KDM4ENPC1NPSR1 | |
| SCHEMBL16535450 | 0.71 | ADORA2A (0.48) | ADORA2AADORA1KDM4ENPC1HTR2C | |
| SCHEMBL16535137 | 0.71 | ADORA1 (0.64) | ADORA2AADORA1HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |