Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | PLK1 | P53350 | 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 | |
|---|---|---|---|---|
| SCHEMBL424650 | 0.89 | MAP4K4 (0.39) | ALDH1A1KDM4ENPC1RAB9AHPGD | |
| SCHEMBL425869 | 0.89 | FAAH (0.43) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL427487 | 0.77 | MAP4K4 (0.36) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL27529994 | 0.72 | ALPL (0.45) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL427535 | 0.71 | CNR2 (0.35) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL427118 | 0.71 | DPP4 (0.40) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL425743 | 0.70 | FAAH (0.43) | ALDH1A1SMN1; SMN2KDM4ERAB9AHPGD | |
| SCHEMBL427620 | 0.69 | KDM4E (0.38) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL7898244 | 0.69 | KMO (0.38) | ALDH1A1SMN1; SMN2KDM4ENPC1RAB9A | |
| SCHEMBL426016 | 0.69 | MAP4K4 (0.42) | ALDH1A1SMN1; SMN2KDM4EHPGDTSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010074588-A2 | PHARMACEUTICAL COMPOUNDS | BIAL - PORTELA & Cª, S.A. (PT) | 2010-07-01 | — | — | WO | disclosed |