Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.43 |
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 6/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CEPT1 | Q9Y6K0 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 5/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30297428 | 1.00 | NPC1 (0.43) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL23034199 | 0.87 | NPC1 (0.44) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL28936208 | 0.86 | NPC1 (0.44) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL29479820 | 0.84 | MAPT (0.50) | NPC1RAB9AMAPTSMN1; SMN2POLB | |
| SCHEMBL23033392 | 0.84 | MAPT (0.50) | NPC1RAB9AMAPTSMN1; SMN2POLB | |
| SCHEMBL23033694 | 0.79 | ALDH1A1 (0.48) | NPC1RAB9AMAPTSMN1; SMN2POLB | |
| SCHEMBL28710788 | 0.77 | NPC1 (0.36) | NPC1RAB9AMEN1KMT2AMAPT | |
| SCHEMBL23033343 | 0.76 | RAB9A (0.50) | NPC1RAB9AMEN1KMT2ACASP3 | |
| SCHEMBL29479768 | 0.76 | SMN1; SMN2 (0.49) | NPC1RAB9ACASP3SENP8SENP7 | |
| SCHEMBL29479680 | 0.76 | RAB9A (0.50) | NPC1RAB9AMEN1KMT2ACASP3 |
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-2021032209-A1 | ANTI-INFLUENZA VIRUS COMPOUND, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2021-02-25 | — | — | WO | disclosed |