Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4A | O75164 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | MLYCD | O95822 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7047054 | 0.85 | ALDH1A1 (0.46) | PKMALDH1A1KDM4A | |
| SCHEMBL7051445 | 0.82 | NPC1 (0.56) | NPC1RAB9ASMN1; SMN2HSP90AA1KDM4A | |
| SCHEMBL4650210 | 0.79 | GRIA1 (0.52) | PKMALDH1A1HPGDL3MBTL1 | |
| Hydrochloric Acid SCHEMBL4650896 | 0.75 | HDAC8 (0.50) | PKMALDH1A1 | |
| SCHEMBL7047062 | 0.72 | NPC1 (0.46) | NPC1RAB9ASMN1; SMN2HSP90AA1KDM4A | |
| SCHEMBL11176654 | 0.70 | NPC1 (0.90) | PKMHPGDNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6830381 | 0.70 | ALDH1A1 (0.59) | PKMALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL6967304 | 0.69 | ALDH1A1 (0.93) | PKMALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL8115111 | 0.69 | NPC1 (0.87) | PKMNPC1RAB9ASMN1; SMN2HSP90AA1 | |
| SCHEMBL4650423 | 0.69 | BCL2 (0.53) | — |
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 |