Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL5282541 | 0.98 | TAAR1 (0.52) | TAAR1AKR1B1SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL3119457 | 0.91 | TAAR1 (0.54) | TAAR1AKR1B1SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL4428349 | 0.89 | TAAR1 (0.61) | TAAR1AKR1B1SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL326538 | 0.81 | TAAR1 (0.58) | TAAR1AKR1B1SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL8308252 | 0.78 | MEN1 (0.51) | TAAR1SMN1; SMN2LMNAALDH1A1MEN1 | |
| SCHEMBL9294572 | 0.78 | TAAR1 (0.50) | TAAR1AKR1B1SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL8070948 | 0.77 | TAAR1 (0.52) | TAAR1LMNAALDH1A1POLB | |
| SCHEMBL8071207 | 0.77 | TAAR1 (0.52) | TAAR1LMNAALDH1A1POLB | |
| SCHEMBL7563447 | 0.77 | TAAR1 (0.52) | TAAR1LMNAALDH1A1POLB | |
| SCHEMBL7562209 | 0.77 | TAAR1 (0.52) | TAAR1LMNAALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016132134-A1 | THIAZOLE DERIVATIVES FOR THE TREATMENT OF ANIMAL TRYPANOSOMIASIS | UNIVERSITY OF DUNDEE (GB) | 2016-08-25 | — | — | WO | disclosed |