Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.54 |
| ▸ | RAB9A | P51151 | 6/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | MITF | O75030 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6950511 | 0.85 | NPC1 (0.55) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL6949189 | 0.80 | MAPK1 (0.57) | NPC1RAB9AKMT2APOLBSMN1; SMN2 | |
| SCHEMBL6948171 | 0.79 | TNF (0.48) | NPC1RAB9APKMKMT2APOLB | |
| SCHEMBL8133266 | 0.78 | NPC1 (0.61) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL6949629 | 0.77 | NPC1 (0.58) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL8125999 | 0.76 | NPC1 (0.59) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL6950499 | 0.76 | NPC1 (0.59) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL6955323 | 0.76 | NPC1 (0.58) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL5454302 | 0.75 | NPC1 (0.77) | NPC1RAB9APKMMITFKMT2A | |
| SCHEMBL6956006 | 0.75 | NPC1 (0.55) | NPC1RAB9APKMMITFKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0903343-B1 | Alpha-Substituted phenylpropionic acid derivative and medicine containing the same | SSP CO LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| EP-0903343-A1 | Alpha-Substituted phenylpropionic acid derivative and medicine containing the same | SSP Co., Ltd. (JP) | 1999-03-24 | — | — | EP | disclosed |