Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.65 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.41 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.41 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.41 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | CHUK | O15111 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | BCR | P11274 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL173641 | 0.89 | KIF11 (0.70) | KIF11USP2RAB9AALDH1A1TSHR | |
| Bromide SCHEMBL28026302 | 0.86 | KIF11 (0.67) | KIF11USP2RAB9AALDH1A1TSHR | |
| Ammonia Solution, Strong SCHEMBL28086851 | 0.86 | KIF11 (0.67) | KIF11USP2RAB9AALDH1A1TSHR | |
| Hydrochloric Acid SCHEMBL7816092 | 0.86 | KIF11 (0.67) | KIF11USP2RAB9AALDH1A1TSHR | |
| SCHEMBL2420544 | 0.85 | USP2 (0.65) | KIF11USP2RAB9ACYP19A1 | |
| Fluoride SCHEMBL17966118 | 0.83 | KIF11 (0.64) | KIF11USP2RAB9AALDH1A1TSHR | |
| SCHEMBL26294659 | 0.82 | ALDH1A1 (0.55) | KIF11USP2RAB9AALDH1A1TSHR | |
| SCHEMBL17966120 | 0.81 | KIF11 (0.61) | KIF11USP2RAB9AALDH1A1TSHR | |
| Cyclohexane SCHEMBL28283907 | 0.81 | KIF11 (0.61) | KIF11USP2RAB9AALDH1A1TSHR | |
| SCHEMBL931294 | 0.79 | KIF11 (1.00) | KIF11NISCHABL1BCR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012087630-A1 | PYRIDINE AND PYRIMIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-06-28 | — | — | WO | claimed |
| WO-2012087630-A1 | PYRIDINE AND PYRIMIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2012-06-28 | — | — | WO | disclosed |