Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | ORAI1 | Q96D31 | 2/20 | 0.35 |
| ▸ | ORAI2 | Q96SN7 | 2/20 | 0.35 |
| ▸ | ORAI3 | Q9BRQ5 | 2/20 | 0.35 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL791334 | 0.81 | ALDH1A1 (0.42) | TSHRALDH1A1SMN1; SMN2GAAHTT | |
| SCHEMBL1237453 | 0.79 | KMT2A (0.42) | TSHRALDH1A1SMN1; SMN2ORAI1ORAI2 | |
| Hydrochloric Acid SCHEMBL3987325 | 0.78 | KMT2A (0.41) | TSHRALDH1A1SMN1; SMN2ORAI1ORAI2 | |
| SCHEMBL5785644 | 0.76 | SMN1; SMN2 (0.49) | TSHRALDH1A1SMN1; SMN2GAAHTT | |
| SCHEMBL651370 | 0.75 | ORAI1 (0.42) | TSHRALDH1A1GAAORAI1ORAI2 | |
| SCHEMBL56273 | 0.75 | ORAI1 (0.42) | TSHRSMN1; SMN2ORAI1ORAI2ORAI3 | |
| SCHEMBL19347408 | 0.75 | SPHK2 (0.37) | TSHRALDH1A1SMN1; SMN2GAAHTT | |
| SCHEMBL1672441 | 0.74 | ORAI1 (0.46) | TSHRALDH1A1ORAI1ORAI2ORAI3 | |
| SCHEMBL910653 | 0.74 | NAPRT (0.41) | TSHRALDH1A1GAAORAI1ORAI2 | |
| SCHEMBL3954847 | 0.73 | CTSS (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1979353-A2 | FUSED HETEROBICYCLIC KINASE INHIBITORS | OSI Pharmaceuticals, Inc. (US) | 2008-10-15 | — | — | EP | disclosed |
| WO-2007084667-A2 | FUSED HETEROBICYCLIC KINASE INHIBITORS | OSI PHARMACEUTICAL, INC. (US) | 2007-07-26 | — | — | WO | disclosed |