Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | RARB | P10826 | 1/20 | 0.36 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9425911 | 0.83 | HSD17B1 (0.37) | — | |
| SCHEMBL2849373 | 0.76 | CES2 (0.42) | NPC1RAB9ASMN1; SMN2MAPK1GRIN2D | |
| SCHEMBL9425916 | 0.72 | CA12 (0.34) | NPC1RAB9ASMN1; SMN2PKMHSD17B10 | |
| SCHEMBL9425670 | 0.72 | XDH (0.38) | NPC1RAB9ASMN1; SMN2RARBFFAR4 | |
| SCHEMBL12311117 | 0.70 | CA1 (0.56) | NPC1RAB9ASMN1; SMN2CA12CA1 | |
| SCHEMBL1713017 | 0.70 | ELANE (0.40) | NPC1ELANECA12CA1CA2 | |
| SCHEMBL8960093 | 0.70 | PTPN1 (0.35) | — | |
| SCHEMBL9426161 | 0.69 | RXRB (0.62) | PDCD1CD274EGFR | |
| SCHEMBL25865911 | 0.67 | SHBG (0.53) | HSD17B10MEN1KMT2A | |
| SCHEMBL13337872 | 0.65 | TDP1 (0.57) | NPC1RAB9ASMN1; SMN2PKMMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5349105-A | Skin disorder | ALLERGAN, INC. (US) | 1994-09-20 | — | — | US | disclosed |
| US-5202471-A | Skin disorders | ALLERGAN, INC. (US) | 1993-04-13 | — | — | US | disclosed |