Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 11/20 | 0.58 |
| ▸ | NPC1 | O15118 | 8/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.56 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | HTR1D | P28221 | 1/20 | 0.52 |
| ▸ | HTR1B | P28222 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL30182537 | 1.00 | RAB9A (0.58) | RAB9ANPC1ATMALDH1A1MAPT | |
| SCHEMBL4609052 | 0.86 | RAB9A (0.69) | RAB9ANPC1ATMALDH1A1MAPT | |
| SCHEMBL29803640 | 0.86 | RAB9A (0.65) | RAB9ANPC1ALDH1A1MAPTKMT2A | |
| SCHEMBL24670696 | 0.86 | RAB9A (0.65) | RAB9ANPC1ALDH1A1MAPTKMT2A | |
| SCHEMBL27905354 | 0.85 | HDAC1 (0.58) | RAB9ANPC1ATMALDH1A1MAPT | |
| SCHEMBL30182470 | 0.85 | RAB9A (0.60) | RAB9ANPC1ALDH1A1MAPTKMT2A | |
| SCHEMBL29434835 | 0.83 | RAB9A (0.70) | RAB9ANPC1MAPTKMT2AMEN1 | |
| SCHEMBL28729250 | 0.83 | RAB9A (0.70) | RAB9ANPC1MAPTKMT2AMEN1 | |
| SCHEMBL24670737 | 0.83 | HTR1D (0.61) | RAB9ANPC1ALDH1A1MAPTKMT2A | |
| SCHEMBL29803389 | 0.83 | HTR1D (0.61) | RAB9ANPC1ALDH1A1MAPTKMT2A |
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-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |