Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.74 |
| ▸ | PKM | P14618 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | NPC1 | O15118 | 2/20 | 0.63 |
| ▸ | RAB9A | P51151 | 2/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.63 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.63 |
| ▸ | CASP3 | P42574 | 1/20 | 0.63 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.63 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.63 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.63 |
| ▸ | CTNNB1 | P35222 | 10/20 | 0.58 |
| ▸ | WNT3A | P56704 | 6/20 | 0.57 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL5207347 | 0.94 | PKM (0.72) | ALDH1A1PKMTSHRHPGDSMN1; SMN2 | |
| SCHEMBL19287097 | 0.85 | PKM (0.68) | ALDH1A1PKMTSHRHPGDNPC1 | |
| SCHEMBL15329853 | 0.85 | ALDH1A1 (0.68) | ALDH1A1PKMTSHRHPGDNPC1 | |
| SCHEMBL4259988 | 0.85 | ALDH1A1 (1.00) | ALDH1A1PKMTSHRHPGDNPC1 | |
| SCHEMBL10091954 | 0.82 | HPGD (0.88) | ALDH1A1PKMTSHRHPGDNPC1 | |
| SCHEMBL653025 | 0.81 | PKM (0.87) | ALDH1A1PKMTSHRHPGDCTNNB1 | |
| SCHEMBL6905348 | 0.79 | ALDH1A1 (0.63) | ALDH1A1PKMTSHRHPGDSMN1; SMN2 | |
| SCHEMBL1443787 | 0.78 | PKM (1.00) | ALDH1A1PKMTSHRHPGDSMN1; SMN2 | |
| SCHEMBL14144501 | 0.78 | ATM (0.87) | ALDH1A1PKMTSHRHPGDNPC1 | |
| SCHEMBL2985748 | 0.78 | ALDH1A1 (0.68) | ALDH1A1PKMTSHRHPGDNPC1 |
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-1421071-A2 | SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS | NOVO NORDISK A/S (DK) | 2004-05-26 | — | — | EP | disclosed |
| WO-2003004480-A2 | SUBSTITUTED PIPERAZINE AND DIAZEPANES AS HISTAMINE H3 RECEPTOR AGONISTS | NOVO NORDISK A/S (DK) | 2003-01-16 | — | — | WO | disclosed |