Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 6/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17773307 | 0.95 | RAB9A (0.47) | RAB9AHPGDLMNAHTTFAAH | |
| SCHEMBL11089043 | 0.78 | HPGD (0.51) | RAB9AHPGDLMNAHTTSMN1; SMN2 | |
| SCHEMBL7801637 | 0.77 | ALDH1A1 (0.55) | RAB9AHPGDLMNAHTTSMN1; SMN2 | |
| SCHEMBL3416627 | 0.77 | RIPK1 (0.52) | RAB9AHPGDLMNAHTTSMN1; SMN2 | |
| SCHEMBL6498349 | 0.76 | TSHR (0.60) | RAB9AHPGDHTTNPC1 | |
| SCHEMBL11472039 | 0.76 | SMN1; SMN2 (0.50) | RAB9AHPGDLMNAHTTSMN1; SMN2 | |
| SCHEMBL8393859 | 0.75 | TSHR (0.46) | RAB9AHPGDLMNAHTTSMN1; SMN2 | |
| SCHEMBL15738726 | 0.75 | SMN1; SMN2 (0.46) | RAB9AHPGDLMNAHTTSMN1; SMN2 | |
| SCHEMBL17766325 | 0.75 | RAB9A (0.52) | RAB9AHPGDLMNAFAAHSMN1; SMN2 | |
| SCHEMBL28593323 | 0.74 | NPC1 (0.58) | RAB9ALMNASMN1; SMN2NPC1ACHE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3037410-B1 | METHOD FOR PRODUCING M-XYLYLENE DIISOCYANATE | MITSUI CHEMICALS INC (JP) | 2018-04-11 | — | — | EP | disclosed |