Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 11/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 10/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.67 |
| ▸ | RAB9A | P51151 | 10/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 10/20 | 0.67 |
| ▸ | HPGD | P15428 | 9/20 | 0.67 |
| ▸ | TP53 | P04637 | 8/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.61 |
| ▸ | PKM | P14618 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | METAP2 | P50579 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13067679 | 0.84 | ALDH1A1 (0.56) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL13621004 | 0.82 | ALDH1A1 (0.53) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL592611 | 0.80 | HSD17B10 (1.00) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL30402966 | 0.80 | ALDH1A1 (0.46) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL13700917 | 0.80 | F2 (0.63) | NPC1ALDH1A1RAB9ASMN1; SMN2HPGD | |
| SCHEMBL824375 | 0.79 | NPC1 (0.69) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL29531707 | 0.79 | NPC1 (0.69) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL2147805 | 0.79 | HSD17B10 (0.96) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL30280651 | 0.76 | ALDH1A1 (1.00) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL11773057 | 0.76 | ALDH1A1 (1.00) | NPC1HSD17B10ALDH1A1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1958585-A | Ruthenium(II)complexes of second generation DNA molecule optical switch, and preparation method | BEIJING TEACHER S UNIV (CN) | 2007-05-09 | — | — | CN | claimed |
| CN-1958585-A | Ruthenium(II)complexes of second generation DNA molecule optical switch, and preparation method | BEIJING TEACHER S UNIV (CN) | 2007-05-09 | — | — | CN | disclosed |