Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GLS | O94925 | 5/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL894206 | 0.87 | RAB9A (0.58) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL27944427 | 0.76 | ALDH1A1 (0.41) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL27944451 | 0.73 | ALDH1A1 (0.41) | RAB9AKMT2AALDH1A1MAPTMEN1 | |
| SCHEMBL4468305 | 0.72 | ALDH1A1 (0.68) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL27903763 | 0.71 | TAAR1 (0.49) | KMT2ASMN1; SMN2ALDH1A1MAPTMEN1 | |
| SCHEMBL27692836 | 0.69 | GAA (0.68) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL32672066 | 0.68 | CCNE1 (0.61) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL9553582 | 0.67 | GAA (0.58) | RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL9156058 | 0.67 | ALDH1A1 (0.60) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL1899086 | 0.66 | ADORA1 (0.56) | RAB9AKMT2ANPC1SMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102458402-B | Nicotinamide compounds useful as kinase modulators | BRISTOL MYERS SQUIBB CO | 2013-10-02 | — | — | CN | disclosed |
| CN-102458402-A | Nicotinamide compounds useful as kinase modulators | BRISTOL MYERS SQUIBB CO | 2012-05-16 | — | — | CN | disclosed |