Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.42 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | KDM1A | O60341 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | GALR2 | O43603 | 1/20 | 0.39 |
| ▸ | GALR1 | P47211 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6563764 | 0.79 | ALDH1A1 (0.41) | LMNARAB9AHTTMAPK1MAPT | |
| SCHEMBL3115364 | 0.79 | TUBB1 (0.47) | TUBB1LMNARAB9AHTTMAPK1 | |
| Hydrochloric Acid SCHEMBL6542615 | 0.78 | ALDH1A1 (0.41) | LMNARAB9AHTTMAPK1MAPT | |
| SCHEMBL20984473 | 0.77 | RAB9A (0.51) | TUBB1LMNARAB9AHTTMAPK1 | |
| SCHEMBL6764946 | 0.77 | LMNA (0.50) | TUBB1LMNARAB9AHTTMAPK1 | |
| SCHEMBL2000165 | 0.77 | TUBB1 (0.46) | TUBB1LMNARAB9AHTTMAPK1 | |
| SCHEMBL20149559 | 0.77 | TUBB1 (0.46) | TUBB1LMNARAB9AHTTMAPK1 | |
| SCHEMBL28658021 | 0.76 | RAPGEF4 (0.42) | RAB9AHTTMAPTMEN1KMT2A | |
| Bromide SCHEMBL20984199 | 0.76 | TUBB1 (0.45) | TUBB1LMNARAB9AHTTMAPK1 | |
| SCHEMBL10984450 | 0.76 | GRM4 (0.47) | MAPK1MAPTMEN1KMT2AALDH1A1 |
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-8884020-B2 | Indole compounds | IRONWOOD PHARMACEUTICALS, INC. (US) | 2014-11-11 | — | — | US | disclosed |