Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.55 |
| ▸ | MAPT | P10636 | 6/20 | 0.55 |
| ▸ | NPC1 | O15118 | 5/20 | 0.55 |
| ▸ | PKM | P14618 | 2/20 | 0.55 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.49 |
| ▸ | C1S | P09871 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.39 |
| ▸ | WNT3A | P56704 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15425129 | 1.00 | RAB9A (0.55) | RAB9AMAPTNPC1PKMATM | |
| SCHEMBL2281973 | 0.76 | NPC1 (0.57) | RAB9AMAPTNPC1PKMATM | |
| SCHEMBL932685 | 0.73 | NPC1 (0.57) | RAB9AMAPTNPC1PKMATM | |
| SCHEMBL1660203 | 0.72 | CTNNB1 (0.61) | RAB9AMAPTNPC1PKMATM | |
| SCHEMBL2968032 | 0.70 | PLAU (0.58) | RAB9AMAPTNPC1PKMKMT2A | |
| Hydrochloric Acid SCHEMBL3102294 | 0.68 | PLAU (0.57) | RAB9AMAPTNPC1PKMKMT2A | |
| SCHEMBL4784460 | 0.67 | NPC1 (0.64) | RAB9AMAPTNPC1PKMATM | |
| SCHEMBL22373684 | 0.65 | PRSS1 (0.62) | PKMC1SKMT2AMAOA | |
| SCHEMBL20997682 | 0.65 | C1S (0.59) | MAPTC1SPOLBMAPK1ALDH1A1 | |
| SCHEMBL423581 | 0.64 | C1S (1.00) | PKMC1SKMT2ASMN1; SMN2 |
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-2017102893-A1 | WATER-SOLUBLE DERIVATIVES OF 3,5-DIPHENYL-DIAZOLE COMPOUNDS | LUDWIG-MAXIMILIANS-UNIVERSITÄT MÜNCHEN (DE) | 2017-06-22 | — | — | WO | disclosed |