Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.61 |
| ▸ | TOP1 | P11387 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.53 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | ESRRG | P62508 | 1/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | SNCA | P37840 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11141910 | 0.93 | ESR1 (0.53) | ESR1TOP1NPC1RAB9AHDAC6 | |
| SCHEMBL11145632 | 0.92 | HSP90AA1 (0.57) | ESR1TOP1NPC1RAB9AHDAC6 | |
| SCHEMBL11136927 | 0.83 | KCNK9 (0.52) | ESR1TOP1NPC1RAB9AHDAC6 | |
| SCHEMBL22746195 | 0.83 | NPC1 (0.63) | NPC1RAB9AHDAC6HDAC3HDAC8 | |
| SCHEMBL11138236 | 0.82 | HDAC3 (0.60) | ESR1NPC1RAB9AHDAC6HDAC3 | |
| SCHEMBL2689722 | 0.81 | ESR1 (0.69) | ESR1ESRRG | |
| SCHEMBL9126532 | 0.80 | ESR1 (0.54) | ESR1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL29696084 | 0.80 | ESR1 (0.95) | ESR1ESRRGTDP1ALDH1A1 | |
| SCHEMBL298974 | 0.80 | ESR1 (0.95) | ESR1ESRRGTDP1ALDH1A1 | |
| SCHEMBL28918150 | 0.78 | MEN1 (0.56) | TOP1NPC1RAB9AHDAC6HDAC3 |
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-4387210-A | Process for producing aromatic polyester amide | MITSUI TOATSU CHEMICAL, INC. (JP) | 1983-06-07 | — | — | US | disclosed |
| EP-0055480-A1 | Process for producing aromatic polyester amide | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1982-07-07 | — | — | EP | disclosed |