Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 10/20 | 0.70 |
| ▸ | RAB9A | P51151 | 10/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.52 |
| ▸ | MYC | P01106 | 2/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11809710 | 0.99 | NPC1 (0.68) | NPC1RAB9AKMT2AHDAC6MYC | |
| SCHEMBL11807169 | 0.88 | NPC1 (0.57) | NPC1RAB9AKMT2AHDAC6MYC | |
| SCHEMBL4883318 | 0.84 | NPC1 (1.00) | NPC1RAB9AKMT2AHDAC6MYC | |
| SCHEMBL1707625 | 0.82 | NPC1 (0.49) | NPC1RAB9AHDAC6TSHRMAPT | |
| SCHEMBL12171414 | 0.82 | NPC1 (0.96) | NPC1RAB9AKMT2AHDAC6MYC | |
| SCHEMBL12171480 | 0.81 | RAB9A (0.81) | NPC1RAB9AKMT2AHDAC6MYC | |
| SCHEMBL27734925 | 0.81 | CDC25B (0.50) | NPC1RAB9APTPN1TSHRMAPT | |
| SCHEMBL11634746 | 0.81 | NPC1 (0.48) | NPC1RAB9AKMT2AMYCTSHR | |
| SCHEMBL11438341 | 0.79 | NPC1 (0.89) | NPC1RAB9AKMT2AHDAC6MYC | |
| SCHEMBL11808344 | 0.77 | CSNK2A2 (0.53) | NPC1RAB9AKMT2ASMN1; SMN2NR1H4 |
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 |
|---|---|---|---|---|---|---|---|
| US-3939115-A | OXADIAZOLES | EASTMAN KODAK COMPANY (US) | 1976-02-17 | — | — | US | disclosed |