Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 6/20 | 0.38 |
| ▸ | CNR2 | P34972 | 6/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20113514 | 0.92 | NPC1 (0.46) | RAB9ANPC1KCNH2CACNA1IKMT2A | |
| SCHEMBL20113478 | 0.91 | PTGER4 (0.43) | KCNH2CACNA1IHDAC6MLYCD | |
| SCHEMBL20113518 | 0.91 | NPC1 (0.41) | RAB9ANPC1KCNH2CACNA1ICNR2 | |
| SCHEMBL16305010 | 0.91 | PTGER4 (0.44) | MEN1KMT2AMAP3K14HTR4RIPK1 | |
| SCHEMBL18626493 | 0.91 | PTGER4 (0.44) | MEN1KMT2AMAP3K14HTR4RIPK1 | |
| SCHEMBL20113498 | 0.88 | HDAC6 (0.38) | KCNH2CACNA1IMEN1KMT2ACNR1 | |
| SCHEMBL20113509 | 0.86 | PTGER4 (0.44) | KCNH2CACNA1IHDAC6MLYCD | |
| SCHEMBL16305011 | 0.83 | PTGER4 (0.43) | KCNH2CACNA1IMEN1KMT2AMAP3K14 | |
| SCHEMBL18626441 | 0.83 | PTGER4 (0.43) | KCNH2CACNA1IMEN1KMT2AMAP3K14 | |
| SCHEMBL20113520 | 0.83 | PTGER4 (0.42) | KCNH2CACNA1IHDAC6MLYCD |
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-3009426-B1 | 4-ALKYNYL IMIDAZOLE DERIVATIVE AND MEDICINE COMPRISING SAME AS ACTIVE INGREDIENT | KAKEN PHARMA CO LTD (JP) | 2018-05-02 | — | — | EP | disclosed |