Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.64 |
| ▸ | ESR1 | P03372 | 1/20 | 0.56 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | SCN1A | P35498 | 2/20 | 0.53 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.53 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.48 |
| ▸ | MMP12 | P39900 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8703432 | 0.90 | ESR1 (0.64) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL8698908 | 0.89 | TDP1 (0.62) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL839075 | 0.89 | TDP1 (0.75) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL3821882 | 0.83 | TDP1 (0.79) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL8679047 | 0.83 | TDP1 (0.66) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL16673090 | 0.82 | TDP1 (0.76) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL6232820 | 0.82 | TDP1 (0.76) | TDP1ESR1ESR2NPC1RAB9A | |
| SCHEMBL8676387 | 0.81 | PTGER1 (0.62) | TDP1ESR1ESR2NPC1RAB9A | |
| Phenethyl Benzoate SCHEMBL168823 | 0.81 | ESR1 (0.80) | TDP1ESR1ESR2NPC1RAB9A | |
| Phenethyl Benzoate SCHEMBL4351681 | 0.81 | ESR1 (0.80) | TDP1ESR1ESR2NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5834468-A | ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS, ANALGESICS TREATING RHEUMATIC DISEASE, BONE DISORDER, INJURIES | ZENECA LIMITED (GB) | 1998-11-10 | — | — | US | disclosed |