Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 4/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
| ▸ | TUBB | P07437 | 1/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.31 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.31 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7346507 | 0.81 | ALDH1A1 (0.36) | ALDH1A1SMN1; SMN2THRATHRBLMNA | |
| SCHEMBL7344148 | 0.77 | KMT2A (0.40) | ALDH1A1SMN1; SMN2KDM4ETDP1THRA | |
| SCHEMBL7344141 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KDM4ETDP1THRATHRB | |
| SCHEMBL7352286 | 0.76 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2KDM4ETDP1THRA | |
| SCHEMBL7348321 | 0.76 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2KDM4ETDP1THRA | |
| SCHEMBL7353139 | 0.74 | THRB (0.40) | ALDH1A1SMN1; SMN2KDM4ETDP1THRA | |
| SCHEMBL2688609 | 0.73 | LMNA (0.48) | ALDH1A1SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL7351859 | 0.70 | ALDH1A1 (0.38) | ALDH1A1SMN1; SMN2KDM4ETDP1THRA | |
| SCHEMBL8570152 | 0.69 | TACR1 (0.47) | ALDH1A1SMN1; SMN2TDP1HTTLMNA | |
| SCHEMBL27475763 | 0.65 | L3MBTL1 (0.60) | ALDH1A1SMN1; SMN2HTTLMNAL3MBTL1 |
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-5284971-A | No cardiac side effects | SYNTEX (U.S.A.) INC. (US) | 1994-02-08 | — | — | US | disclosed |