Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.32 |
| ▸ | CTSS | P25774 | 2/20 | 0.32 |
| ▸ | CTSK | P43235 | 2/20 | 0.32 |
| ▸ | CTSL | P07711 | 1/20 | 0.32 |
| ▸ | CTSB | P07858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15632930 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TSHRDPP4CTSSCTSK | |
| SCHEMBL20565192 | 0.77 | DPP4 (0.35) | ALDH1A1TSHRDPP4CTSSCTSK | |
| SCHEMBL11120681 | 0.75 | ALDH1A1 (0.33) | ALDH1A1TSHRDPP4 | |
| SCHEMBL327452 | 0.73 | DGAT1 (0.37) | DPP4 | |
| SCHEMBL20358288 | 0.73 | CTSS (0.36) | ALDH1A1TSHRDPP4CTSSCTSK | |
| SCHEMBL18730442 | 0.72 | CTSS (0.33) | ALDH1A1TSHRDPP4CTSSCTSK | |
| SCHEMBL18730330 | 0.69 | CTSS (0.31) | CTSSCTSK | |
| SCHEMBL3685287 | 0.67 | — | — | |
| SCHEMBL2167514 | 0.65 | — | — | |
| SCHEMBL209810 | 0.65 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3194386-A2 | SGC STIMULATORS | Ironwood Pharmaceuticals, Inc. (US) | 2017-07-26 | — | — | EP | disclosed |
| EP-3092231-A1 | SGC STIMULATORS | Ironwood Pharmaceuticals, Inc. (US) | 2016-11-16 | — | — | EP | disclosed |
| WO-2016044446-A2 | SGC STIMULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2016-03-24 | — | — | WO | disclosed |
| WO-2015089182-A1 | SGC STIMULATORS | IRONWOOD PHARMACEUTICALS, INC. (US) | 2015-06-18 | — | — | WO | disclosed |