Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.44 |
| ▸ | RAB9A | P51151 | 8/20 | 0.44 |
| ▸ | POLB | P06746 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL9187106 | 0.99 | NPC1 (0.45) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL9186051 | 0.90 | NPC1 (0.42) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL705766 | 0.89 | NPC1 (0.40) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL1451220 | 0.88 | NPC1 (0.40) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL9187940 | 0.86 | NPC1 (0.41) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL6920544 | 0.86 | POLB (0.44) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL9187122 | 0.85 | NPC1 (0.39) | NPC1RAB9APOLBLMNA | |
| SCHEMBL9183881 | 0.82 | NPC1 (0.50) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL2065312 | 0.82 | NPC1 (0.42) | NPC1RAB9APOLBLMNAKDM4E | |
| SCHEMBL2065314 | 0.80 | NPC1 (0.43) | NPC1RAB9APOLBLMNAKDM4E |
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-6740317-B1 | AQUEOUS HAIR CARE COMPOSITION COMPRISING MACROCYCLIC LACTONE AND EICOSANOATE ESTER | MELALEUCA, INC. | 2004-05-25 | — | — | US | disclosed |
| US-6620410-B1 | Containing grape skin extract | MELALEUCA, INC. | 2003-09-16 | — | — | US | disclosed |