Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.68 |
| ▸ | RAB9A | P51151 | 3/20 | 0.68 |
| ▸ | GAA | P10253 | 3/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL238548 | 0.87 | ALDH1A1 (0.66) | NPC1RAB9AALDH1A1KDM4ELMNA | |
| SCHEMBL28645469 | 0.83 | NPC1 (0.68) | NPC1RAB9AGAAALDH1A1KDM4E | |
| SCHEMBL11536532 | 0.81 | GAA (0.54) | NPC1RAB9AGAAALDH1A1KDM4E | |
| SCHEMBL11535253 | 0.81 | EPHX1 (0.75) | GAAALDH1A1LMNAMAPTHPGD | |
| SCHEMBL11533636 | 0.81 | ALDH1A1 (0.66) | NPC1RAB9AGAAALDH1A1KDM4E | |
| SCHEMBL19277753 | 0.80 | ALDH1A1 (0.73) | NPC1RAB9AGAAALDH1A1KDM4E | |
| SCHEMBL646296 | 0.80 | HPGD (0.66) | NPC1RAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL29524654 | 0.80 | HPGD (0.66) | NPC1RAB9AALDH1A1KDM4EHPGD | |
| SCHEMBL5450559 | 0.80 | ALDH1A1 (0.77) | NPC1RAB9AGAAALDH1A1KDM4E | |
| SCHEMBL29635526 | 0.80 | ALDH1A1 (0.77) | NPC1RAB9AGAAALDH1A1KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4134914-A | 1-Acyl-4-substituted phenyl thiosemicarbazides | ELI LILLY AND COMPANY (US) | 1979-01-16 | — | — | US | claimed |
| US-4134914-A | 1-Acyl-4-substituted phenyl thiosemicarbazides | ELI LILLY AND COMPANY (US) | 1979-01-16 | — | — | US | disclosed |
| US-4082762-A | 4-(2-HALOPHENYL)-1,2,4-TRIAZOLE-3-THIOL COMPOUNDS | ELI LILLY AND COMPANY (US) | 1978-04-04 | — | — | US | disclosed |
| US-3937713-A | Process for the preparation of s-triazolo[3,4-b]benzothiazoles | ELI LILLY AND COMPANY (US) | 1976-02-10 | — | — | US | disclosed |