Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.31 |
| ▸ | NOS3 | P29474 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL5148507 | 1.00 | HSP90AA1 (0.35) | HSP90AA1ALDH1A1CYP1A2TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL5148533 | 0.97 | HSP90AA1 (0.33) | HSP90AA1ALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL5148537 | 0.97 | HSP90AA1 (0.33) | HSP90AA1ALDH1A1CYP1A2KDM4ETDP1 | |
| SCHEMBL16077910 | 0.89 | HSP90AA1 (0.38) | HSP90AA1ALDH1A1CYP1A2TSHRKDM4E | |
| SCHEMBL3689609 | 0.82 | KDM4E (0.53) | HSP90AA1ALDH1A1KDM4ETDP1 | |
| SCHEMBL3689607 | 0.82 | KDM4E (0.53) | HSP90AA1ALDH1A1KDM4ETDP1 | |
| SCHEMBL15082906 | 0.81 | NOS1 (0.41) | HSP90AA1ALDH1A1TSHRKDM4EALOX15 | |
| SCHEMBL15858695 | 0.81 | ALDH1A1 (0.39) | HSP90AA1ALDH1A1CYP1A2TSHRKDM4E | |
| SCHEMBL16077909 | 0.81 | HSP90AA1 (0.36) | HSP90AA1ALDH1A1CYP1A2TSHRKDM4E | |
| SCHEMBL15082910 | 0.80 | ALDH1A1 (0.41) | HSP90AA1ALDH1A1CYP1A2KDM4ETDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1379562-B1 | SUPPORTED OLEFIN POLYMERIZATION CATALYSTS | DU PONT (US) | 2007-08-29 | — | — | EP | disclosed |
| US-6900153-B2 | Supported olefin polymerization catalysts | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2005-05-31 | — | — | US | disclosed |
| US-20020187892-A1 | Supported olefin polymerization catalysts | E. I. DU PONT DE NEMOURS AND COMPANY | 2002-12-12 | — | — | US | disclosed |