Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL2856673 | 0.77 | ALDH1A1 (0.33) | SLC6A2TAAR1ALDH1A1TSHRTDP1 | |
| SCHEMBL2852140 | 0.75 | ALDH1A1 (0.37) | SLC6A2TAAR1ALDH1A1TSHRTDP1 | |
| SCHEMBL2912079 | 0.75 | TP53 (0.36) | ALDH1A1TSHR | |
| SCHEMBL30616094 | 0.75 | TP53 (0.36) | ALDH1A1TSHR | |
| SCHEMBL2850053 | 0.72 | TDP1 (0.42) | SLC6A2TAAR1ALDH1A1TSHRTDP1 | |
| SCHEMBL2854576 | 0.72 | SLC6A2 (0.33) | SLC6A2TAAR1ALDH1A1TSHRTDP1 | |
| SCHEMBL4438970 | 0.70 | CYP3A4 (0.41) | ALDH1A1TSHRTDP1 | |
| SCHEMBL4449690 | 0.69 | TP53 (0.32) | ALDH1A1 | |
| Carbon Monoxide SCHEMBL11677050 | 0.67 | MEN1 (0.31) | ALDH1A1 | |
| SCHEMBL7557905 | 0.67 | ACHE (0.43) | TAAR1ALDH1A1TSHRTDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |