Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.50 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.50 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 1/20 | 0.42 |
| ▸ | AKT2 | P31751 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31237237 | 1.00 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1NR1H4PARP1RAB9A | |
| Sulfuric Acid SCHEMBL8465210 | 0.95 | HSP90AA1 (0.46) | HSP90AA1HSP90AB1NR1H4PARP1RAB9A | |
| SCHEMBL8464925 | 0.90 | HSP90AA1 (0.63) | HSP90AA1HSP90AB1NR1H4PARP1RAB9A | |
| SCHEMBL8468193 | 0.84 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1PARP1RAB9ANPC1 | |
| SCHEMBL28557674 | 0.83 | TDP2 (0.50) | HSP90AA1HSP90AB1NR1H4RAB9ANPC1 | |
| SCHEMBL29846716 | 0.83 | TDP2 (0.50) | HSP90AA1HSP90AB1NR1H4RAB9ANPC1 | |
| SCHEMBL8466530 | 0.82 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1RAB9ANPC1ALDH1A1 | |
| SCHEMBL8465416 | 0.82 | HSP90AA1 (0.50) | HSP90AA1HSP90AB1PARP1RAB9ANPC1 | |
| SCHEMBL8465216 | 0.78 | HSP90AA1 (0.79) | HSP90AA1HSP90AB1 | |
| SCHEMBL8465273 | 0.78 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1PARP1RAB9ANPC1 |
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-5981544-A | Mono-- or diketone tetracyclic derivatives and therapeutical uses thereof | LABORATOIRE INNOTHERA (FR) | 1999-11-09 | — | — | US | claimed |
| US-5981544-A | Mono-- or diketone tetracyclic derivatives and therapeutical uses thereof | LABORATOIRE INNOTHERA (FR) | 1999-11-09 | — | — | US | disclosed |