Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.61 |
| ▸ | POLB | P06746 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | S100A4 | P26447 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6198227 | 0.91 | ITGB2 (0.55) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL7839139 | 0.89 | KMT2A (0.62) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL27490593 | 0.88 | ALDH1A1 (0.62) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL6196535 | 0.86 | ITGB2 (0.52) | ALDH1A1KMT2A | |
| SCHEMBL27491653 | 0.85 | ALDH1A1 (0.48) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL6197668 | 0.84 | KMT2A (0.48) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL6199842 | 0.81 | ALDH1A1 (0.47) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL6198247 | 0.81 | ITGB2 (0.53) | ALDH1A1KMT2AMAPTHTTTP53 | |
| SCHEMBL27490592 | 0.80 | CYP1A2 (0.71) | ALDH1A1POLBSMN1; SMN2KMT2AMAPT | |
| SCHEMBL6196816 | 0.79 | ITGB2 (0.69) | MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140814-A2 | CELL ADHESION-INHIBITING ANTIINFLAMMATORY AND IMMUNE-SUPPRESSIVE COMPOUNDS | ABBOTT LABORATORIES (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000039081-A2 | CELL ADHESION-INHIBITING ANTIINFLAMMATORY AND IMMUNE-SUPPRESSIVE COMPOUNDS | ABBOTT LABORATORIES (US) | 2000-07-06 | — | — | WO | disclosed |