Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | MITF | O75030 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL678935 | 0.81 | KMT2A (0.57) | NPC1KMT2AL3MBTL1MEN1POLB | |
| SCHEMBL508956 | 0.74 | PTGS2 (0.50) | KMT2AMEN1POLBMAPTCYP2D6 | |
| SCHEMBL17776425 | 0.74 | CNR1 (0.55) | KMT2AALDH1A1HTTKCNQ2KDM4E | |
| SCHEMBL3700677 | 0.74 | CNR1 (0.55) | KMT2AALDH1A1HTTKCNQ2KDM4E | |
| SCHEMBL18526676 | 0.74 | CNR1 (0.55) | KMT2AALDH1A1HTTKCNQ2KDM4E | |
| SCHEMBL1072709 | 0.72 | ALDH1A1 (0.54) | KMT2AALDH1A1HTTKCNQ2KDM4E | |
| SCHEMBL26802536 | 0.72 | ALDH1A1 (0.54) | KMT2AALDH1A1HTTKCNQ2KDM4E | |
| SCHEMBL10728103 | 0.72 | PTGS2 (0.48) | CYP2D6 | |
| SCHEMBL3410010 | 0.72 | ALDH1A1 (0.50) | KMT2AMEN1ALDH1A1CYP2D6 | |
| SCHEMBL13389325 | 0.72 | ALDH1A1 (0.50) | KMT2AMEN1ALDH1A1CYP2D6 |
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-3933803-A | ANTIBACTERIAL, ANTIMITOTIC, ANTIMYCOTIC | INSTITUTO LUSO FARMACO D'ITALIA S.R.L. (IT) | 1976-01-20 | — | — | US | disclosed |