Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CCR1 | P32246 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | CCR8 | P51685 | 1/20 | 0.47 |
| ▸ | METAP1 | P53582 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7964667 | 0.93 | ALOX5 (0.56) | CYP3A4ALOX5LMNASMN1; SMN2NR4A2 | |
| SCHEMBL14745014 | 0.81 | GABRA5 (0.61) | CYP3A4ALOX5LMNASMN1; SMN2NR4A2 | |
| SCHEMBL20653207 | 0.80 | P4HTM (0.54) | CYP3A4KDM4ELMNASMN1; SMN2MAOB | |
| SCHEMBL2873418 | 0.80 | CYP3A4 (0.52) | CYP3A4ALOX5ALDH1A1MEN1KMT2A | |
| SCHEMBL9679303 | 0.79 | CCR1 (0.50) | CYP3A4ALOX5ALDH1A1MEN1KMT2A | |
| SCHEMBL23406054 | 0.78 | HPGDS (0.52) | CYP3A4ALDH1A1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL29743942 | 0.78 | HPGDS (0.52) | CYP3A4ALDH1A1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL27743534 | 0.78 | CYP1A2 (0.61) | CYP3A4MEN1KMT2ALMNASMN1; SMN2 | |
| SCHEMBL16025388 | 0.77 | ALOX5 (0.55) | CYP3A4ALOX5LMNASMN1; SMN2NR4A2 | |
| SCHEMBL501711 | 0.77 | MAOB (0.60) | CYP3A4ALOX5MEN1KMT2AMAOB |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6187928-B1 | TREATING FUNGAL DISEASES | THE ROCKEFELLER UNIVERSITY | 2001-02-13 | — | — | US | disclosed |
| US-6087510-A | Method of use of imidazolium cations | THE ROCKEFELLER UNIVERSITY (US) | 2000-07-11 | — | — | US | disclosed |
| US-5969150-A | FLUORESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS, DRUGS AND LABELS OR FUNGICIDES AND VIRICIDES | THE ROCKEFELLER UNIVERSITY (US) | 1999-10-19 | — | — | US | disclosed |
| US-5874587-A | FLUORESCENCE | THE ROCKEFELLER UNIVERSITY (US) | 1999-02-23 | — | — | US | disclosed |