Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CHKA | P35790 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.33 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL2852601 | 0.77 | CALM1 (0.41) | ALDH1A1TSHRCYP3A4LMNASMN1; SMN2 | |
| SCHEMBL2093279 | 0.76 | CALM1 (0.50) | LMNACALM1 | |
| SCHEMBL8089580 | 0.75 | TP53 (0.46) | ALDH1A1CYP3A4MAPK1LMNASMN1; SMN2 | |
| SCHEMBL27610744 | 0.74 | ALDH1A1 (0.33) | ALDH1A1TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL7014345 | 0.73 | CALM1 (0.41) | ALDH1A1CYP3A4KMT2ACALM1ALOX15 | |
| SCHEMBL6981018 | 0.73 | MAOB (0.42) | ALDH1A1TDP1CALM1GAAAOC3 | |
| SCHEMBL16601111 | 0.73 | CALM1 (0.41) | ALDH1A1TSHRTDP1LMNAHTT | |
| SCHEMBL2154106 | 0.73 | MEN1 (0.44) | ALDH1A1CYP3A4KMT2ACALM1GAA | |
| SCHEMBL1419583 | 0.73 | CALM1 (0.33) | ALDH1A1TSHRCYP3A4MAPK1TDP1 | |
| SCHEMBL8602727 | 0.73 | ALOX5 (0.47) | TSHRCYP3A4SMN1; SMN2KMT2ACALM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5516797-A | SUPPRESSING GRAFT REJECTION | VERTEX PHARMACEUTICALS, INCORPORATED (US) | 1996-05-14 | — | — | US | disclosed |
| US-4587538-A | Record material | THE WIGGINS TEAPE GROUP LIMITED (GB) | 1986-05-06 | — | — | US | disclosed |