Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.47 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KLK7 | P49862 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL10699049 | 0.85 | CA2 (0.46) | HTTKDM4ELMNACTBP2 | |
| SCHEMBL11730655 | 0.83 | CES1 (0.52) | KDM4ESMN1; SMN2NPC1LMNAALDH1A1 | |
| SCHEMBL13012117 | 0.82 | HTT (0.59) | HTTKDM4EPOLBSMN1; SMN2NPC1 | |
| SCHEMBL17009142 | 0.81 | ALOX5 (0.56) | POLBF2RL1ALDH1A1KMT2ARAB9A | |
| SCHEMBL6026975 | 0.81 | HTT (0.58) | HTTKDM4EPOLBSMN1; SMN2NPC1 | |
| SCHEMBL17210682 | 0.77 | CES1 (0.58) | HTTKDM4EPOLBSMN1; SMN2CTBP2 | |
| SCHEMBL13903099 | 0.76 | PTPRB (0.54) | HTTSMN1; SMN2NPC1LMNAF2RL1 | |
| SCHEMBL313139 | 0.74 | HTT (0.69) | HTTKDM4EPOLBSMN1; SMN2NPC1 | |
| SCHEMBL28354143 | 0.74 | PTPRB (0.49) | HTTSMN1; SMN2NPC1LMNAF2RL1 | |
| SCHEMBL3628705 | 0.74 | HTT (0.68) | HTTKDM4EPOLBSMN1; SMN2NPC1 |
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-0252639-A1 | Leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1988-01-13 | — | — | EP | disclosed |
| US-4012392-A | ANALGESICS, MORPHINE ANTAGONISTS | ACF CHEMIEFARMA N.V. (NL) | 1977-03-15 | — | — | US | disclosed |