Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7053357 | 0.78 | PKM (0.59) | ALDH1A1MAPTL3MBTL1TSHRSMN1; SMN2 | |
| SCHEMBL7050251 | 0.74 | TP53 (0.43) | ALDH1A1TP53KDM4EMAPTL3MBTL1 | |
| SCHEMBL4651093 | 0.73 | TSHR (0.37) | ALDH1A1TP53MAPTL3MBTL1NPC1 | |
| SCHEMBL280401 | 0.72 | MMP8 (0.56) | NPC1TSHRSMN1; SMN2MMP8 | |
| Ammonia Solution, Strong SCHEMBL28259601 | 0.70 | MMP8 (0.54) | NPC1TSHRSMN1; SMN2MMP8 | |
| SCHEMBL5901121 | 0.69 | — | — | |
| SCHEMBL7504111 | 0.66 | GHSR (0.47) | TP53KDM4ENPC1TSHRSMN1; SMN2 | |
| SCHEMBL9629339 | 0.65 | MMP8 (0.51) | NPC1TSHRSMN1; SMN2MMP8CYP1A2 | |
| SCHEMBL27629137 | 0.65 | MMP8 (0.51) | NPC1TSHRSMN1; SMN2MMP8 | |
| SCHEMBL6287198 | 0.64 | MMP8 (0.57) | NPC1TSHRSMN1; SMN2MMP8 |
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-1301474-A2 | TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS | Array Biopharma Inc. (US) | 2003-04-16 | — | — | EP | disclosed |
| WO-2002004412-A2 | TYROSINE DERIVATIVES AS PHOSPHATASE INHIBITORS | ARRAY BIOPHARMA INC. (US) | 2002-01-17 | — | — | WO | disclosed |