Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL31347392 | 0.83 | TDP1 (0.46) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL10718341 | 0.83 | TDP1 (0.46) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL17124497 | 0.80 | TDP1 (0.42) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL1369592 | 0.78 | CYP3A4 (0.41) | TDP1CYP3A4DRD1ESR1ESR2 | |
| Acetic Acid SCHEMBL31362943 | 0.77 | ALDH1A1 (0.41) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL2856673 | 0.77 | ALDH1A1 (0.33) | TDP1SLC6A2TAAR1ALDH1A1TSHR | |
| Bromide SCHEMBL31398207 | 0.75 | CYP3A4 (0.46) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL30085602 | 0.75 | TDP1 (0.46) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL15698213 | 0.75 | CYP3A4 (0.46) | TDP1CYP3A4DRD1ESR1ESR2 | |
| SCHEMBL10792614 | 0.75 | TDP1 (0.46) | TDP1CYP3A4DRD1ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8436111-B2 | Nickel catalyst system for the preparation of high CIS polybutadiene | BRIDGESTONE CORPORATION (JP) | 2013-05-07 | — | — | US | claimed |
| US-20100093920-A1 | NICKEL CATALYST SYSTEM FOR THE PREPARATION OF HIGH CIS POLYBUTADIENE | BRIDGESTONE CORPORATION (JP) | 2010-04-15 | — | — | US | claimed |
| US-8436111-B2 | Nickel catalyst system for the preparation of high CIS polybutadiene | BRIDGESTONE CORPORATION (JP) | 2013-05-07 | — | — | US | disclosed |
| US-20100093920-A1 | NICKEL CATALYST SYSTEM FOR THE PREPARATION OF HIGH CIS POLYBUTADIENE | BRIDGESTONE CORPORATION (JP) | 2010-04-15 | — | — | US | disclosed |