Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | BCL2 | P10415 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17738268 | 0.85 | CACNA1I (0.41) | HTR4 | |
| SCHEMBL27684193 | 0.79 | NPC1 (0.57) | NPC1RAB9AMEN1KMT2ACNR2 | |
| SCHEMBL4217851 | 0.76 | NPC1 (0.51) | NPC1RAB9AMEN1KMT2ACNR2 | |
| SCHEMBL17739049 | 0.75 | KDM4E (0.48) | NPC1RAB9AMEN1KMT2ACNR2 | |
| SCHEMBL17739048 | 0.73 | CA1 (0.50) | KMT2ACA2 | |
| SCHEMBL30783784 | 0.73 | POLB (0.47) | NPC1RAB9AMEN1KMT2ACNR2 | |
| SCHEMBL23675404 | 0.72 | NPC1 (0.64) | NPC1RAB9AMEN1KMT2ACNR2 | |
| SCHEMBL14734915 | 0.71 | CNR2 (0.49) | NPC1RAB9AMEN1KMT2ACNR2 | |
| SCHEMBL589624 | 0.71 | CHRM1 (0.54) | NPC1RAB9ACNR2CNR1POLB | |
| SCHEMBL22787631 | 0.71 | F2 (0.54) | MEN1KMT2ACA2F2PLG |
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-2016071293-A2 | PHARMACEUTICAL COMPOUND | IOMET PHARMA LTD (GB) | 2016-05-12 | — | — | WO | disclosed |