Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | FPR1 | P21462 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | MLKL | Q8NB16 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7433448 | 0.87 | ALDH1A1 (0.56) | IDO1KMT2AALDH1A1POLBCYP3A4 | |
| SCHEMBL5626297 | 0.84 | KMT2A (0.57) | IDO1KMT2AALDH1A1POLBCYP3A4 | |
| SCHEMBL28419559 | 0.82 | ALDH1A1 (0.58) | IDO1KMT2AALDH1A1FPR1SMN1; SMN2 | |
| SCHEMBL28416316 | 0.82 | ALDH1A1 (0.58) | IDO1KMT2AALDH1A1FPR1SMN1; SMN2 | |
| SCHEMBL28415424 | 0.82 | ALDH1A1 (0.58) | IDO1KMT2AALDH1A1FPR1SMN1; SMN2 | |
| SCHEMBL28421573 | 0.82 | ALDH1A1 (0.58) | IDO1KMT2AALDH1A1FPR1SMN1; SMN2 | |
| SCHEMBL28420241 | 0.82 | ALDH1A1 (0.58) | IDO1KMT2AALDH1A1FPR1SMN1; SMN2 | |
| SCHEMBL6063463 | 0.82 | IDO1 (0.53) | IDO1KMT2AALDH1A1POLBCYP3A4 | |
| Methylamine SCHEMBL10866955 | 0.82 | KMT2A (0.52) | IDO1KMT2AALDH1A1POLBCYP3A4 | |
| Ammonia Solution, Strong SCHEMBL10866532 | 0.81 | IDO1 (0.51) | IDO1KMT2AALDH1A1POLBCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5278166-A | 4-amino-3-heteroaryl butyric acid compounds, compositions, and their use for treating disorders involving a dysfunction of GABAB receptors | ADIR ET COMPAGNIE (FR) | 1994-01-11 | — | — | US | disclosed |