Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 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 | |
|---|---|---|---|---|
| SCHEMBL10730204 | 0.88 | RAB9A (0.44) | MAPK1SMN1; SMN2RAB9ANPC1KDM4E | |
| SCHEMBL10726181 | 0.86 | NPC1 (0.52) | MAPK1SMN1; SMN2RAB9ANPC1KDM4E | |
| SCHEMBL10653229 | 0.78 | RAB9A (0.58) | MAPK1SMN1; SMN2RAB9ANPC1KDM4E | |
| Ammonia Solution, Strong SCHEMBL10762399 | 0.77 | SMN1; SMN2 (0.47) | SMN1; SMN2RAB9ANPC1KDM4EMEN1 | |
| SCHEMBL10726176 | 0.77 | RAB9A (0.48) | MAPK1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL10730199 | 0.75 | RAB9A (0.47) | MAPK1SMN1; SMN2RAB9ANPC1KDM4E | |
| SCHEMBL28745032 | 0.75 | PKM (0.61) | MAPK1SMN1; SMN2RAB9ANPC1KDM4E | |
| SCHEMBL7423671 | 0.75 | L3MBTL1 (0.58) | MAPK1SMN1; SMN2RAB9ANPC1MEN1 | |
| Ammonia Solution, Strong SCHEMBL10762388 | 0.74 | NPC1 (0.43) | MAPK1SMN1; SMN2RAB9ANPC1KMT2A | |
| SCHEMBL27739386 | 0.74 | SMN1; SMN2 (0.53) | MAPK1SMN1; SMN2RAB9ANPC1KDM4E |
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-4652653-A | Process for the preparation of β-(benzothiazolylthio)- and β-(benzimidazolylthio)-carboxylic acid derivatives | CIBA-GEIGY CORPORATION (US) | 1987-03-24 | — | — | US | disclosed |