Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | THPO | P40225 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.39 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TNF | P01375 | 1/20 | 0.39 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20734675 | 0.85 | ACHE (0.46) | IDO1RAB9ACYP1A2NPC1TNF | |
| SCHEMBL22288725 | 0.82 | IDO1 (0.47) | IDO1RAB9ACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL3297899 | 0.79 | IDO1 (0.48) | IDO1RAB9ACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL10294717 | 0.78 | IDO1 (0.53) | IDO1SMN1; SMN2ALDH1A1HPGDKMT2A | |
| SCHEMBL10204873 | 0.78 | TAAR1 (0.53) | IDO1CYP1A2CYP2D6CYP2C19LMNA | |
| SCHEMBL15023253 | 0.77 | IDO1 (0.47) | IDO1RAB9ACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL172930 | 0.76 | — | — | |
| SCHEMBL14153123 | 0.76 | MAOB (0.48) | RAB9ANPC1TNFNOD1MAOB | |
| SCHEMBL10294709 | 0.76 | RAB9A (0.49) | IDO1RAB9ANPC1LMNASMN1; SMN2 | |
| SCHEMBL29722898 | 0.76 | RAB9A (0.49) | IDO1RAB9ANPC1LMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009140205-A2 | THERAPEUTIC SUBSTITUTED CYCLOPENTANES | ALLERGAN, INC. (US) | 2009-11-19 | — | — | WO | disclosed |