Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | GAA | P10253 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | NSD2 | O96028 | 1/20 | 0.41 |
| ▸ | BRPF1 | P55201 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6230772 | 0.85 | SMN1; SMN2 (0.58) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL18965901 | 0.81 | KDM4E (0.43) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL521102 | 0.79 | KDM4E (0.55) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL31473995 | 0.78 | SMN1; SMN2 (0.58) | SMN1; SMN2NPC1ALDH1A1RAB9ATP53 | |
| SCHEMBL4539855 | 0.78 | SMN1; SMN2 (0.58) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL17674019 | 0.78 | SMN1; SMN2 (0.58) | SMN1; SMN2NPC1ALDH1A1RAB9ATP53 | |
| SCHEMBL2634929 | 0.78 | SMN1; SMN2 (0.58) | SMN1; SMN2NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL20982581 | 0.76 | KDM4E (0.68) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL23679807 | 0.76 | SMN1; SMN2 (0.55) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A | |
| SCHEMBL6592993 | 0.75 | MCHR1 (0.39) | SMN1; SMN2KDM4ENPC1ALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005035526-A1 | BICYCLIC COMPOUNDS AND THEIR THERAPEUTIC USE | ARGENTA DISCOVERY LTD. (GB) | 2005-04-21 | — | — | WO | disclosed |
| WO-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |