Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.38 |
| ▸ | L3MBTL3 | Q96JM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL19049368 | 1.00 | NOTUM (0.42) | NOTUMFAAHSIGMAR1CHRNA7CTSB | |
| SCHEMBL28956406 | 0.84 | ALDH1A1 (0.42) | CTSBMAPTLMNAPOLBHTT | |
| SCHEMBL27759918 | 0.84 | GSK3B (0.42) | MAPTTSHRHTTCYP2D6GSK3B | |
| SCHEMBL27781453 | 0.83 | GRM1 (0.52) | CHRNA7GSK3B | |
| SCHEMBL27542639 | 0.82 | NOTUM (0.41) | NOTUMSIGMAR1MAPTTSHRDRD2 | |
| SCHEMBL14473329 | 0.81 | ALDH1A1 (0.34) | HRH3ALDH1A1 | |
| SCHEMBL27702488 | 0.77 | GRM1 (0.54) | MAPTTSHRALDH1A1DRD2CYP2D6 | |
| SCHEMBL3567530 | 0.75 | ESR1 (0.52) | NOTUMSIGMAR1CHRNA7DRD2 | |
| SCHEMBL12662987 | 0.75 | ESR1 (0.52) | NOTUMSIGMAR1CHRNA7DRD2 | |
| SCHEMBL13380548 | 0.75 | ESR1 (0.52) | NOTUMSIGMAR1CHRNA7DRD2 |
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-1531822-B1 | 1-ARYL-4-SUBSTITUTED PIPERAZINE DERIVATIVES FOR USE AS CCR1 ANTAGONISTS FOR THE TREATMENT OF INFLAMMATION AND IMMUNE DISORDERS | CHEMOCENTRYX INC (US) | 2009-08-05 | — | — | EP | disclosed |