Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | MGLL | Q99685 | 2/20 | 0.48 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.44 |
| ▸ | TACR3 | P29371 | 1/20 | 0.44 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21964564 | 0.87 | NPC1 (0.51) | NPC1RAB9ASMN1; SMN2MGLLFAAH | |
| SCHEMBL16797992 | 0.84 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2MGLLFAAH | |
| SCHEMBL18300903 | 0.76 | ATM (0.41) | NPC1RAB9ASMN1; SMN2POLBALDH1A1 | |
| SCHEMBL27457954 | 0.75 | GSK3B (0.40) | PTGDR2 | |
| SCHEMBL5578485 | 0.74 | NPC1 (0.41) | NPC1RAB9ASMN1; SMN2MGLLFAAH | |
| SCHEMBL15516309 | 0.73 | NPC1 (0.66) | NPC1RAB9ASMN1; SMN2MGLLPOLB | |
| SCHEMBL21960979 | 0.72 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2MGLLFAAH | |
| SCHEMBL31422519 | 0.72 | NPC1 (0.50) | NPC1RAB9ASMN1; SMN2MGLLPOLB | |
| SCHEMBL10874779 | 0.72 | NPC1 (0.68) | NPC1RAB9ASMN1; SMN2POLBKMT2A | |
| SCHEMBL5853278 | 0.71 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2MGLLPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015082411-A1 | ARYL- AND HETARYL-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINE-3-CARBOXAMIDES AND USE THEREOF | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2015-06-11 | — | — | WO | disclosed |