Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL8605062 | 0.91 | SMN1; SMN2 (0.39) | ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL8602166 | 0.82 | NPC1 (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL12849888 | 0.73 | CASR (0.58) | — | |
| SCHEMBL7473593 | 0.72 | TSHR (0.61) | ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL7469321 | 0.69 | TSHR (0.58) | ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL14507328 | 0.68 | PPARG (0.42) | ALDH1A1SMN1; SMN2TSHRHPGDHTT | |
| SCHEMBL7471315 | 0.63 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL7465025 | 0.63 | TSHR (0.55) | ALDH1A1SMN1; SMN2MEN1KMT2AMAPK1 | |
| SCHEMBL15270129 | 0.63 | TNKS (0.60) | — | |
| SCHEMBL15270126 | 0.63 | TNKS (0.60) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5854242-A | Benzoxazine antimicrobial agents | ORTHO PHARMACEUTICAL CORPORATION (US) | 1998-12-29 | — | — | US | disclosed |
| US-5696117-A | BACTERICIDE | ORTHO PHARMACEUTICAL CORPORATION (US) | 1997-12-09 | — | — | US | disclosed |