Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 7/20 | 0.35 |
| ▸ | NPC1 | O15118 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11268173 | 0.82 | MEN1 (0.41) | ALDH1A1RAB9ANPC1MAPTALOX12 | |
| SCHEMBL11247372 | 0.77 | MAPT (0.41) | ALDH1A1RAB9AMAPTHTTKMT2A | |
| SCHEMBL850628 | 0.74 | ALDH1A1 (0.46) | ALDH1A1RAB9ANPC1MAPTCHRNA1 | |
| SCHEMBL18556032 | 0.74 | RAB9A (0.43) | ALDH1A1RAB9ANPC1MAPTCHRNA1 | |
| SCHEMBL11262550 | 0.73 | PDE5A (0.35) | ALDH1A1RAB9ANPC1MAPTHTT | |
| SCHEMBL11257421 | 0.72 | APEX1 (0.45) | ALDH1A1SLC6A2SLC6A4SLC6A3LMNA | |
| SCHEMBL11250175 | 0.72 | CES2 (0.38) | ALDH1A1CHRNA1CHRNGCHRNB1CHRNB2 | |
| SCHEMBL1883344 | 0.72 | MAPT (0.47) | ALDH1A1RAB9ANPC1MAPTKMT2A | |
| Hydrochloric Acid SCHEMBL11639231 | 0.71 | APEX1 (0.44) | ALDH1A1SLC6A2SLC6A4SLC6A3LMNA | |
| SCHEMBL9638977 | 0.69 | ALDH1A1 (0.44) | ALDH1A1RAB9AMAPTALOX12HTT |
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-4358611-A | FROM A PHENYLHYDRAZINE, A CHLOROFORMATE, PHOSGENE AND A SECONDARY AMINE | SHELL OIL COMPANY (US) | 1982-11-09 | — | — | US | disclosed |