Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 1/20 | 0.58 |
| ▸ | HMOX1 | P09601 | 1/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | QPCT | Q16769 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | NOS1 | P29475 | 1/20 | 0.49 |
| ▸ | HMOX2 | P30519 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5760109 | 0.82 | HMOX1 (0.65) | HMOX1CYP19A1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL1927388 | 0.82 | KMT2A (0.71) | ALDH1A1SMN1; SMN2KDM4EQPCTKMT2A | |
| SCHEMBL5759151 | 0.81 | HMOX1 (0.64) | HMOX1CYP19A1ALDH1A1SMN1; SMN2KDM4E | |
| SCHEMBL1928520 | 0.78 | TBXAS1 (0.68) | ALDH1A1SMN1; SMN2KDM4EKMT2ANPSR1 | |
| 3-(Benzyloxy)Aniline SCHEMBL291445 | 0.76 | MAOB (1.00) | MAOBSMN1; SMN2CYP3A4 | |
| 3-(Benzyloxy)Aniline SCHEMBL29428912 | 0.76 | MAOB (1.00) | MAOBSMN1; SMN2CYP3A4 | |
| SCHEMBL10290016 | 0.75 | KMT2A (0.68) | ALDH1A1SMN1; SMN2KDM4EKMT2ANPSR1 | |
| SCHEMBL5759785 | 0.75 | HMOX1 (0.85) | HMOX1CYP19A1CYP11B1CYP11B2QPCT | |
| 3-(Benzyloxy)Aniline SCHEMBL11263814 | 0.75 | MAOB (0.96) | MAOBSMN1; SMN2CYP3A4 | |
| SCHEMBL5757778 | 0.74 | HMOX1 (0.83) | HMOX1CYP19A1CYP11B1CYP11B2QPCT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1049682-A1 | OXAZOLIDINONE COMBINATORIAL LIBRARIES, COMPOSITIONS AND METHODS OF PREPARATION | Versicor, Inc. (US) | 2000-11-08 | — | — | EP | disclosed |
| WO-1999037630-A1 | OXAZOLIDINONE COMBINATORIAL LIBRARIES, COMPOSITIONS AND METHODS OF PREPARATION | VERSICOR, INC. (US) | 1999-07-29 | — | — | WO | disclosed |