Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NAAA | Q02083 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.40 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CASP2 | P42575 | 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 | |
|---|---|---|---|---|
| SCHEMBL20663408 | 0.81 | CA12 (0.37) | SMN1; SMN2POLBKDM4ENPC1RAB9A | |
| SCHEMBL8002161 | 0.74 | KDM4E (0.49) | L3MBTL1ALDH1A1SMN1; SMN2KDM4ERAB9A | |
| SCHEMBL8000377 | 0.72 | SMPD1 (0.39) | LMNAKDM4E | |
| SCHEMBL17580836 | 0.72 | NAAA (0.54) | L3MBTL1ALDH1A1LMNASMN1; SMN2NAAA | |
| SCHEMBL18896240 | 0.71 | POLB (0.77) | L3MBTL1ALDH1A1LMNASMN1; SMN2NAAA | |
| SCHEMBL20152042 | 0.71 | POLB (0.77) | L3MBTL1ALDH1A1LMNASMN1; SMN2NAAA | |
| SCHEMBL30545066 | 0.71 | EPHX1 (0.57) | L3MBTL1ALDH1A1LMNASMN1; SMN2NAAA | |
| SCHEMBL8544861 | 0.70 | SMPD1 (0.53) | SMN1; SMN2KDM4EHPGDNPC1TP53 | |
| SCHEMBL13729263 | 0.70 | L3MBTL1 (0.47) | L3MBTL1ALDH1A1LMNASMN1; SMN2NAAA | |
| SCHEMBL13729514 | 0.70 | L3MBTL1 (0.47) | L3MBTL1ALDH1A1LMNASMN1; SMN2NAAA |
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-3781142-A1 | NOVEL [1.1.1] BICYCLO COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS | Merck Sharp&Dohme Corp. (US) | 2021-02-24 | — | — | EP | claimed |
| WO-2019204180-A1 | NOVEL [1.1.1] BICYCLO COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2019-10-24 | — | — | WO | claimed |