Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 7/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13711770 | 0.74 | IDO1 (0.58) | IDO1HPGDKMT2ALMNAMEN1 | |
| SCHEMBL13633817 | 0.72 | IDO1 (0.60) | IDO1KMT2AMEN1TAAR1L3MBTL1 | |
| SCHEMBL5378420 | 0.68 | SMN1; SMN2 (0.75) | SMN1; SMN2HPGDKMT2ALMNAMEN1 | |
| SCHEMBL15457421 | 0.68 | IDO1 (0.64) | IDO1SMN1; SMN2KMT2AMEN1L3MBTL1 | |
| SCHEMBL23374691 | 0.67 | TAAR1 (0.61) | IDO1SMN1; SMN2LMNATAAR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11779371 | 0.67 | IDO1 (0.66) | IDO1SMN1; SMN2KMT2ALMNAMEN1 | |
| Hydrochloric Acid SCHEMBL5386116 | 0.67 | SMN1; SMN2 (0.72) | SMN1; SMN2HPGDLMNATAAR1TDP1 | |
| Butane SCHEMBL7059838 | 0.65 | IDO1 (0.59) | IDO1HPGDKMT2ALMNAMEN1 | |
| SCHEMBL3321590 | 0.64 | IDO1 (1.00) | IDO1 | |
| SCHEMBL14232683 | 0.64 | SMN1; SMN2 (0.58) | SMN1; SMN2TAAR1TDP1ALDH1A1POLB |
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-2008025152-A1 | ANTIBACTERIAL AGENTS | MCMASTER UNIVERSITY (CA) | 2008-03-06 | — | — | WO | disclosed |