Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.47 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.47 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.47 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.47 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.47 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.47 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.46 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.46 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11936135 | 0.84 | KMT2A (0.50) | KMT2APOLBCYP3A4CYP2D6PSEN1 | |
| SCHEMBL11935346 | 0.81 | CYP3A4 (0.45) | KMT2APOLBCYP3A4PKMLMNA | |
| SCHEMBL13565011 | 0.81 | CA1 (0.53) | KMT2APOLBLMNAMEN1KDM4E | |
| SCHEMBL13565304 | 0.80 | KCNJ1 (0.41) | KMT2APOLBCYP2D6KCNJ1MEN1 | |
| SCHEMBL10116408 | 0.78 | NPC1 (0.65) | KMT2APOLBCYP3A4CYP2D6PSEN1 | |
| SCHEMBL11936031 | 0.77 | PKM (0.45) | KMT2APOLBCYP3A4CYP2D6PSEN1 | |
| SCHEMBL11935328 | 0.77 | FFAR1 (0.55) | KMT2ACYP3A4MEN1CA1CA2 | |
| SCHEMBL13105744 | 0.77 | CA1 (0.55) | KMT2APOLBLMNAMEN1KDM4E | |
| SCHEMBL11935335 | 0.77 | LTA4H (0.41) | KCNJ1EDNRBEDNRACA1CA2 | |
| SCHEMBL11935693 | 0.77 | IMPDH2 (0.46) | KMT2APOLBCYP3A4CYP2D6PSEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |
| US-8299265-B2 | Amine derivatives having NPY Y5 receptor antagonistic activity and the uses thereof | SHIONOGI & CO., LTD. (JP) | 2012-10-30 | — | — | US | disclosed |