Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | FABP7 | O15540 | 1/20 | 0.56 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.48 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.48 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL27793138 | 0.97 | ALDH1A1 (0.61) | ALDH1A1FABP7FABP5KMT2ASMN1; SMN2 | |
| SCHEMBL8587581 | 0.95 | ALDH1A1 (0.63) | ALDH1A1FABP7FABP5KMT2ASMN1; SMN2 | |
| SCHEMBL8502974 | 0.94 | FABP7 (0.58) | ALDH1A1FABP7FABP5HTTSMN1; SMN2 | |
| SCHEMBL8191635 | 0.94 | FABP7 (0.58) | ALDH1A1FABP7FABP5HTTSMN1; SMN2 | |
| SCHEMBL8477590 | 0.88 | FABP7 (0.60) | ALDH1A1FABP7FABP5SMN1; SMN2NPC1 | |
| SCHEMBL10639541 | 0.88 | FABP7 (0.60) | ALDH1A1FABP7FABP5SMN1; SMN2NPC1 | |
| SCHEMBL3736983 | 0.88 | FABP7 (0.53) | ALDH1A1FABP7FABP5HTTSMN1; SMN2 | |
| SCHEMBL8571449 | 0.85 | ALDH1A1 (0.53) | ALDH1A1FABP7FABP5KMT2ANPC1 | |
| SCHEMBL17714399 | 0.85 | ALDH1A1 (0.47) | ALDH1A1FABP7FABP5SMN1; SMN2 | |
| SCHEMBL10635858 | 0.84 | FABP7 (0.50) | ALDH1A1FABP7FABP5HTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-104024248-A | SERINE/THREONINE PAK1 INHIBITORS | HOFFMANN LA ROCHE | 2014-09-03 | — | — | CN | disclosed |
| CN-104011050-A | 2, 4-diamino-pyrimidine derivatives as serine/threonine kinase inhibitors | HOFFMANN LA ROCHE | 2014-08-27 | — | — | CN | disclosed |