Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 4/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | TYMP | P19971 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL9349977 | 0.93 | TYMP (0.31) | TYMP | |
| SCHEMBL7144899 | 0.92 | PSMB5 (0.31) | PSMB5PTGS2TYMPTDP1PSMB1 | |
| SCHEMBL27588117 | 0.84 | — | — | |
| SCHEMBL2449071 | 0.84 | TYMP (0.31) | TYMP | |
| SCHEMBL5327628 | 0.83 | TYMP (0.33) | TYMPTDP1ALDH1A1CYP3A4ACMSD | |
| SCHEMBL4133594 | 0.81 | TYMP (0.32) | TYMPTDP1ALDH1A1CYP3A4ACMSD | |
| SCHEMBL5197664 | 0.78 | — | — | |
| SCHEMBL5197663 | 0.78 | — | — | |
| SCHEMBL296554 | 0.78 | TYMP (0.42) | PSMB5PTGS2TYMPTDP1PSMB1 | |
| SCHEMBL6726934 | 0.77 | — | — |
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-1123299-A1 | PREPARATION OF BIS ARYL CYCLOPENTADIENYL GROUP IVA METAL DIHALIDES | BOULDER SCIENTIFIC COMPANY (US) | 2001-08-16 | — | — | EP | disclosed |
| WO-2001014389-A1 | PREPARATION OF BIS ARYL CYCLOPENTADIENYL GROUP IVA METAL DIHALIDES | BOULDER SCIENTIFIC COMPANY (US) | 2001-03-01 | — | — | WO | disclosed |
| US-6124489-A | Preparation of bis aryl cyclopentadienyl Group IVA metal dihalides | BOULDER SCIENTIFIC COMPANY (US) | 2000-09-26 | — | — | US | disclosed |