Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | MMP8 | P22894 | 1/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28771185 | 0.80 | ALDH1A1 (0.44) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL28771501 | 0.78 | ALDH1A1 (0.41) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL20600234 | 0.76 | ALDH1A1 (0.40) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL20599579 | 0.76 | ALDH1A1 (0.40) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL6697255 | 0.75 | ALDH1A1 (0.50) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL4728435 | 0.75 | ALDH1A1 (0.33) | ALDH1A1POLBHSD11B1SMN1; SMN2 | |
| SCHEMBL30443406 | 0.75 | ALDH1A1 (0.54) | ALDH1A1POLBHPGDMEN1KMT2A | |
| SCHEMBL3740475 | 0.74 | POLB (0.58) | ALDH1A1POLBMEN1KMT2ANPSR1 | |
| SCHEMBL8250570 | 0.74 | POLB (0.58) | ALDH1A1POLBMEN1KMT2ANPSR1 | |
| SCHEMBL20599636 | 0.73 | MGAM (0.38) | ALDH1A1POLBHPGDL3MBTL1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021026803-A1 | PIPERIDINYL-METHYL-PURINEAMINES AS NSD2 INHIBITORS AND ANTI-CANCER AGENTS | NOVARTIS AG (CH) | 2021-02-18 | — | — | WO | disclosed |