Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.33 |
| ▸ | RELA | Q04206 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8431264 | 0.74 | CA1 (0.36) | CA1CA2CA4LMNAKMT2A | |
| SCHEMBL6777725 | 0.73 | RAB9A (0.50) | CA1CA2KMT2AMEN1NPC1 | |
| SCHEMBL8429166 | 0.70 | CA1 (0.43) | CA1CA2CA4KMT2AMEN1 | |
| SCHEMBL8429109 | 0.70 | MEN1 (0.37) | CYP1A2CA1CA2CA4KMT2A | |
| SCHEMBL8542413 | 0.69 | KCNK3 (0.41) | CA1CA2CA4LMNAKMT2A | |
| SCHEMBL8431435 | 0.68 | CA1 (0.32) | CA1CA2CA4LMNAKMT2A | |
| SCHEMBL8532972 | 0.68 | KMT2A (0.33) | CYP1A2KMT2AMEN1NPC1MAPT | |
| SCHEMBL8432262 | 0.68 | ERCC5 (0.38) | CYP1A2CA1CA2CA4KMT2A | |
| SCHEMBL8430799 | 0.68 | SIRT2 (0.41) | KMT2AMEN1SMN1; SMN2ALDH1A1TP53 | |
| SCHEMBL8697026 | 0.67 | CA1 (0.40) | CA1CA2CA4KMT2AMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5952381-A | SELECTIVELY INHIBITING OR ANTAGONIZING THE INTEGRINS; ANTITUMOR AGENTS, ANTIARTHRITIC AGENTS, VIRICIDES, MICROBIOCIDES; TREATING OSTEOPOROSIS, SKIN DISORDERS | G. D. SEARLE & CO. (US) | 1999-09-14 | — | — | US | disclosed |