Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.62 |
| ▸ | MAPT | P10636 | 5/20 | 0.62 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | CTSV | O60911 | 1/20 | 0.54 |
| ▸ | CTSL | P07711 | 1/20 | 0.54 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.52 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | PPIA | P62937 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28174395 | 0.90 | CYP19A1 (0.60) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL1319458 | 0.88 | CTSV (0.63) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL4649097 | 0.86 | MEN1 (0.60) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL2297894 | 0.85 | MEN1 (0.66) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL20581857 | 0.85 | KMT2A (0.58) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL11736604 | 0.85 | PTGDR2 (0.53) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL9384445 | 0.84 | PTGDR2 (0.53) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL6567396 | 0.84 | MEN1 (0.64) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL11640349 | 0.84 | PTGDR2 (0.53) | MEN1KMT2AMAPTCYP19A1ALDH1A1 | |
| SCHEMBL9384290 | 0.82 | PTGDR2 (0.52) | MEN1KMT2AMAPTCYP19A1ALDH1A1 |
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-0641311-A1 | NOVEL DIHYDROXYBENZYLAMINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | Aventis Pharma S.A. (FR) | 1995-03-08 | — | — | EP | disclosed |
| WO-1993023364-A1 | NOVEL DIHYDROXYBENZYLAMINE DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | RHONE-POULENC RORER S.A. (FR) | 1993-11-25 | — | — | WO | disclosed |