Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 4/20 | 0.39 |
| ▸ | MMP7 | P09237 | 4/20 | 0.39 |
| ▸ | MMP12 | P39900 | 4/20 | 0.39 |
| ▸ | MMP13 | P45452 | 4/20 | 0.39 |
| ▸ | ACE | P12821 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.36 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Butyltriphenylphosphonium SCHEMBL6928248 | 0.84 | CNR2 (0.45) | NR1I2MMP1MMP7MMP12MMP13 | |
| Butyltriphenylphosphonium SCHEMBL3950032 | 0.81 | S1PR3 (0.40) | NR1I2MMP1MMP7MMP12MMP13 | |
| Butyltriphenylphosphonium SCHEMBL28694042 | 0.81 | CHRNA7 (0.48) | NR1I2MMP1MMP13TRAP1KMT2A | |
| Butyltriphenylphosphonium SCHEMBL31425590 | 0.80 | NR1I2 (0.39) | NR1I2MMP1MMP7MMP12MMP13 | |
| Butyltriphenylphosphonium SCHEMBL1804186 | 0.79 | HIF1A (0.44) | MMP1MMP7MMP12MMP13ACE | |
| SCHEMBL9675753 | 0.79 | NR1I2 (0.48) | NR1I2HIF1ASMN1; SMN2ALDH1A1TRAP1 | |
| SCHEMBL9634519 | 0.79 | NR1I2 (0.48) | NR1I2HIF1ASMN1; SMN2ALDH1A1TRAP1 | |
| Sulfuric Acid SCHEMBL21933060 | 0.79 | TRAP1 (0.47) | NR1I2HIF1AALDH1A1TRAP1CYP1A2 | |
| SCHEMBL9634528 | 0.78 | NR1I2 (0.40) | NR1I2TDP1ALDH1A1TRAP1CYP1A2 | |
| Butyltriphenylphosphonium SCHEMBL8375252 | 0.78 | PTGS2 (0.47) | NR1I2MMP1MMP7MMP12MMP13 |
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-9920084-B2 | Ionic tags for synthesis of oligoribonucleotides | THE ROYAL INSTITUTION FOR THE ADVANCEMENT OF LEARNING/MCGILL UNIVERSITY (CA) | 2018-03-20 | — | — | US | disclosed |