Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGA4 | P13612 | 1/20 | 0.39 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | FABP4 | P15090 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7181588 | 0.95 | ITGA4 (0.39) | ITGA4ITGB7CA12CA1CA2 | |
| SCHEMBL27486315 | 0.92 | CA12 (0.44) | ITGA4ITGB7CA12CA1CA2 | |
| SCHEMBL27500963 | 0.88 | FABP4 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7181671 | 0.87 | CA12 (0.44) | ITGA4ITGB7CA12CA1CA2 | |
| SCHEMBL27484989 | 0.86 | L3MBTL1 (0.41) | ITGA4FABP4ALDH1A1LMNAKMT2A | |
| SCHEMBL7181234 | 0.85 | LMNA (0.42) | ITGA4ALDH1A1LMNAKMT2AMAPT | |
| SCHEMBL27485975 | 0.85 | MMP8 (0.47) | CA12CA1CA2CA7CA9 | |
| SCHEMBL27485320 | 0.85 | AKR1C3 (0.44) | CA12CA1CA2CA7CA9 | |
| SCHEMBL7189706 | 0.83 | FABP4 (0.44) | ITGA4CA12CA1CA2CA7 | |
| SCHEMBL27554208 | 0.83 | MEN1 (0.40) | CA12CA1CA2CA7CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1200943-C | Organometallic acyl-aryl phosphine | CIBA SC HOLDING AG (CH) | 2005-05-11 | — | — | CN | disclosed |
| CN-1308081-A | Organometallic acyl-aryl phosphine | CIBA SC HOLDING AG (CH) | 2001-08-15 | — | — | CN | disclosed |